![CAS 1520084-19-8 Tert-Butyl 3-Thia-6-Azabicyclo[3.1.1]Heptane-6-Carboxylate 3,3-Dioxide(WXC00720) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1520084-19-8.gif)
CAS RN: 1520084-19-8
Tert-Butyl 3-Thia-6-Azabicyclo[3.1.1]Heptane-6-Carboxylate 3,3-Dioxide(WXC00720)
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.20251201 | 100mg / 250mg / 500mg | Out of stock | 1 business days | Inquiry |
- Product code: starshine_CAS1520084-19-8
- Purity/Analytical Methods: >99.0%
1520084-19-8 / tert-butyl 3,3-dioxo-3lambda6-thia-6-azabicyclo[3.1.1]heptane-6-carboxylate
Basic Information
CAS
1520084-19-8
Multi CAS
No
Molecular Formula
C10H17NO4S
Molecular Weight
247.310000
Exact Mass
247.087829
SMILES
CC(C)(C)OC(=O)N1C2CC1CS(=O)(=O)C2
InChI
InChI=1S/C10H17NO4S/c1-10(2,3)15-9(12)11-7-4-8(11)6-16(13,14)5-7/h7-8H,4-6H2,1-3H3
InChIKey
ABNDLXCLZZFFSQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Fraction Csp3
0.9
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
58.92
TPSA
63.68
LogP / Solubility
WLOGP
0.79
MLOGP
0.7
XLogP3
0.5
Consensus LogP
0.66
Log S (ESOL)
-1.87
Class (ESOL)
Soluble
Log S (Ali)
-2.16
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.93
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.67
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5
Customers Also Viewed
-
![CAS 1520084-22-3 3-Thia-6-Azabicyclo[3.1.1]Heptane 3,3-Dioxide 4-Methylbenzenesulfonate molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
3-Thia-6-Azabicyclo[3.1.1]Heptane 3,3-Dioxide 4-Methylbenzenesulfonate
- CAS RN: 1520084-22-3
- Product Code: starshine_CAS1520084-22-3
- Purity/Analytical method: >99.0%
-
3-Thia-8-azabicyclo[3.2.1]octane-8-carboxylic acid, 1,1-dimethylethyl ester
- CAS RN: 1520084-33-6
- Product Code: SSC-061807
-
4-AMino-6-Methyl-pyriMidine-2-carboxylic acid Methyl ester
- CAS RN: 1520279-43-9
- Product Code: SSC-061816
-
2,4-dichloro-5h,6h,7h-pyrrolo[2,3-d]pyrimidin-6-one
- CAS RN: 1520452-96-3
- Product Code: SSC-061829
-
-
![CAS 1520084-22-3 3-Thia-6-Azabicyclo[3.1.1]Heptane 3,3-Dioxide 4-Methylbenzenesulfonate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1520084-22-3.gif)
![CAS 1520084-33-6 3-Thia-8-azabicyclo[3.2.1]octane-8-carboxylic acid, 1,1-dimethylethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1520084-33-6.gif)
![CAS 1520452-96-3 2,4-dichloro-5h,6h,7h-pyrrolo[2,3-d]pyrimidin-6-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1520452-96-3.gif)
