![CAS 1823264-83-0 5-(tert-butyl) 1-ethyl 5-azaspiro[2.3]hexane-1,5-dicarboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1823264-83-0.gif)
CAS RN: 1823264-83-0
5-(tert-butyl) 1-ethyl 5-azaspiro[2.3]hexane-1,5-dicarboxylate
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250408 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1823264-83-0
- Purity/Analytical Methods: >99.0%
1823264-83-0 / 5-O-tert-butyl 2-O-ethyl 5-azaspiro[2.3]hexane-2,5-dicarboxylate
Basic Information
CAS
1823264-83-0
Multi CAS
No
Molecular Formula
C13H21NO4
Molecular Weight
255.310000
Exact Mass
255.147058
SMILES
CCOC(=O)C1CC12CN(C2)C(=O)OC(C)(C)C
InChI
InChI=1S/C13H21NO4/c1-5-17-10(15)9-6-13(9)7-14(8-13)11(16)18-12(2,3)4/h9H,5-8H2,1-4H3
InChIKey
DCPDPEJWXBANLM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Fraction Csp3
0.85
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
64.98
TPSA
55.84
LogP / Solubility
WLOGP
1.81
MLOGP
1.6
XLogP3
1.4
Consensus LogP
1.6
Log S (ESOL)
-2.43
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.96
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.06
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.99
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
Customers Also Viewed
-
![CAS 1823265-04-8 4-Boc-6-ethynyl-3,4-dihydro-2H-benzo[b][1,4]oxazine molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
4-Boc-6-ethynyl-3,4-dihydro-2H-benzo[b][1,4]oxazine
- CAS RN: 1823265-04-8
- Product Code: SSC-083518
-
tert-butyl N-(6-formylpyridazin-3-yl)carbamate
- CAS RN: 1823265-06-0
- Product Code: SSC-083519
-
Tert-Butyl 1-Amino-3-Oxa-9-Azaspiro[5.5]Undecane-9-Carboxylate(WX101436)
- CAS RN: 1823266-62-1
- Product Code: starshine_CAS1823266-62-1
- Purity/Analytical method: >99.0%
-
4-(4-Benzylmorpholin-2-Yl)Pyrimidine-5-Carboxylic Acid
- CAS RN: 1823266-78-9
- Product Code: starshine_CAS1823266-78-9
- Purity/Analytical method: >99.0%
-
tert-butyl 7-hydroxy-1-azaspiro[4.4]nonane-1-carboxylate
- CAS RN: 1823268-34-3
- Product Code: SSC-083523
-
7-Bromo-1-methyl-1H-pyrazolo[4,3-b]pyridine
- CAS RN: 1823268-58-1
- Product Code: SSC-083524
![CAS 1823265-04-8 4-Boc-6-ethynyl-3,4-dihydro-2H-benzo[b][1,4]oxazine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1823265-04-8.gif)
![CAS 1823266-62-1 Tert-Butyl 1-Amino-3-Oxa-9-Azaspiro[5.5]Undecane-9-Carboxylate(WX101436) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1823266-62-1.gif)
![CAS 1823268-34-3 tert-butyl 7-hydroxy-1-azaspiro[4.4]nonane-1-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1823268-34-3.gif)
![CAS 1823268-58-1 7-Bromo-1-methyl-1H-pyrazolo[4,3-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1823268-58-1.gif)