![CAS 1160247-38-0 Tert-Butyl 7-Bromo-2,3-Dihydrospiro[Indene-1,4′-Piperidine]-1′-Carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1160247-38-0.gif)
CAS RN: 1160247-38-0
Tert-Butyl 7-Bromo-2,3-Dihydrospiro[Indene-1,4′-Piperidine]-1′-Carboxylate
- Product code: SSC-016087
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
1160247-38-0 / tert-butyl 4-bromospiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxylate
tert-Butyl 7-bromo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate | MFCD12198594 | tert-butyl 4-bromospiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxylate
Basic Information
CAS
1160247-38-0
Multi CAS
No
Molecular Formula
C18H24BrNO2
Molecular Weight
366.300000
Exact Mass
365.099040
SMILES
CC(C)(C)OC(=O)N1CCC2(CCC3=C2C(=CC=C3)Br)CC1
InChI
InChI=1S/C18H24BrNO2/c1-17(2,3)22-16(21)20-11-9-18(10-12-20)8-7-13-5-4-6-14(19)15(13)18/h4-6H,7-12H2,1-3H3
InChIKey
MUPLPTOMZDEVMZ-UHFFFAOYSA-N
Synonyms
tert-Butyl 7-bromo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate
MFCD12198594
tert-butyl 4-bromospiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxylate
Tert-Butyl 7-Bromo-2,3-Dihydrospiro[Indene-1,4-Piperidine]-1-Carboxylate
DTXSID401129190
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.61
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
91.18
TPSA
29.54
LogP / Solubility
WLOGP
4.66
MLOGP
4.12
XLogP3
4.6
Consensus LogP
4.46
Log S (ESOL)
-5.25
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.93
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.91
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.64
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
![CAS 1160247-52-8 Tert-Butyl 7-Bromo-3-Oxo-2,3-Dihydrospiro[Indene-1,4′-Piperidine]-1′-Carboxylate molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
Tert-Butyl 7-Bromo-3-Oxo-2,3-Dihydrospiro[Indene-1,4′-Piperidine]-1′-Carboxylate
- CAS RN: 1160247-52-8
- Product Code: starshine_CAS1160247-52-8
- Purity/Analytical method: >99.0%
-
Tert-Butyl 2′-Oxo-2′,4′-Dihydro-1’H-Spiro[Pyrrolidine-3,3′-Quinoline]-1-Carboxylate
- CAS RN: 1160247-71-1
- Product Code: starshine_CAS1160247-71-1
- Purity/Analytical method: >99.0%
-
tert-Butyl 4-bromo-1,2-dihydrospiro[indole-3,4′-piperidine]-1′-carboxylate
- CAS RN: 1160247-72-2
- Product Code: starshine_CAS1160247-72-2
- Purity/Analytical method: >99.0%
-
4-AMINO-3,4-DIHYDRO-SPIRO[2H-1-BENZOPYRAN-2,4′-PIPERIDINE]-1′-CARBOXYLIC ACID 1,1-DIMETHYLETHYL ESTER
- CAS RN: 1160247-73-3
- Product Code: SSC-016088
-
1′-(TERT-BUTOXYCARBONYL)SPIRO[CHROMENE-2,4′-PIPERIDINE]-4-CARBOXYLIC ACID
- CAS RN: 1160247-75-5
- Product Code: SSC-016089
-
TERT-BUTYL 2′,4′-DIHYDRO-1’H-SPIRO[PIPERIDINE-4,3′-QUINOLINE]-1-CARBOXYLATE
- CAS RN: 1160247-77-7
- Product Code: starshine_CAS1160247-77-7
- Purity/Analytical method: >99.0%
![CAS 1160247-52-8 Tert-Butyl 7-Bromo-3-Oxo-2,3-Dihydrospiro[Indene-1,4′-Piperidine]-1′-Carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1160247-52-8.gif)
![CAS 1160247-71-1 Tert-Butyl 2′-Oxo-2′,4′-Dihydro-1’H-Spiro[Pyrrolidine-3,3′-Quinoline]-1-Carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1160247-71-1.gif)
![CAS 1160247-72-2 tert-Butyl 4-bromo-1,2-dihydrospiro[indole-3,4′-piperidine]-1′-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1160247-72-2.gif)
![CAS 1160247-73-3 4-AMINO-3,4-DIHYDRO-SPIRO[2H-1-BENZOPYRAN-2,4′-PIPERIDINE]-1′-CARBOXYLIC ACID 1,1-DIMETHYLETHYL ESTER molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1160247-73-3.gif)
![CAS 1160247-75-5 1′-(TERT-BUTOXYCARBONYL)SPIRO[CHROMENE-2,4′-PIPERIDINE]-4-CARBOXYLIC ACID molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1160247-75-5.gif)
![CAS 1160247-77-7 TERT-BUTYL 2′,4′-DIHYDRO-1’H-SPIRO[PIPERIDINE-4,3′-QUINOLINE]-1-CARBOXYLATE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1160247-77-7.gif)