![CAS 1546502-59-3 8-Amino-6-azaspiro[3.4]octan-5-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1546502-59-3.gif)
CAS RN: 1546502-59-3
8-Amino-6-azaspiro[3.4]octan-5-one
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.20250828 | 100mg / 250mg / 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1546502-59-3
- Purity/Analytical Methods: >99.0%
1546502-59-3 / 8-amino-6-azaspiro[3.4]octan-5-one
Basic Information
CAS
1546502-59-3
Multi CAS
No
Molecular Formula
C7H12N2O
Molecular Weight
140.180000
Exact Mass
140.094963
SMILES
C1CC2(C1)C(CNC2=O)N
InChI
InChI=1S/C7H12N2O/c8-5-4-9-6(10)7(5)2-1-3-7/h5H,1-4,8H2,(H,9,10)
InChIKey
DBJORCIZFLDOKK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.86
H-bond acceptors
2
H-bond donors
2
Molar refractivity
37.27
TPSA
55.12
LogP / Solubility
WLOGP
-0.39
MLOGP
-0.35
XLogP3
-0.7
Consensus LogP
-0.48
Log S (ESOL)
-0.47
Class (ESOL)
Very soluble
Log S (Ali)
-0.43
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.25
Class (SILICOS-IT)
Very 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)
-3.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
1,2,3-benzoxadiazole-7-carboxylic acid
- CAS RN: 1546503-21-2
- Product Code: starshine_CAS1546503-21-2
- Purity/Analytical method: >99.0%
-
1-methyl-1H-pyrazolo[3,4-c]pyridine-3-carboxylic acid
- CAS RN: 1546503-81-4
- Product Code: SSC-063998
-
1-Cyclobutyl-1H-imidazole-5-carboxylic acid
- CAS RN: 1547005-30-0
- Product Code: starshine_CAS1547005-30-0
- Purity/Analytical method: >99.0%
-
4-Methyl-5-(Trifluoromethyl)-4H-1,2,4-Triazol-3-Amine
- CAS RN: 1547010-07-0
- Product Code: SSC-064038
-
-
7-Chloro-1-methyl-1H-pyrrolo[3,2-b]pyridine
- CAS RN: 1547041-34-8
- Product Code: starshine_CAS1547041-34-8
- Purity/Analytical method: >99.0%
![CAS 1546503-81-4 1-methyl-1H-pyrazolo[3,4-c]pyridine-3-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1546503-81-4.gif)
![CAS 1547041-34-8 7-Chloro-1-methyl-1H-pyrrolo[3,2-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1547041-34-8.gif)