![CAS 1365570-36-0 7-Aza-spiro[3.5]nonan-2-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1365570-36-0.gif)
CAS RN: 1365570-36-0
7-Aza-spiro[3.5]nonan-2-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.20260611 | 50mg / 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1365570-36-0
- Purity/Analytical Methods: >99.0%
1365570-36-0 / 7-azaspiro[3.5]nonan-2-one
Basic Information
CAS
1365570-36-0
Multi CAS
No
Molecular Formula
C8H13NO
Molecular Weight
139.190000
Exact Mass
139.099714
SMILES
C1CNCCC12CC(=O)C2
InChI
InChI=1S/C8H13NO/c10-7-5-8(6-7)1-3-9-4-2-8/h9H,1-6H2
InChIKey
RQQHBATVNAPEIV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.88
H-bond acceptors
2
H-bond donors
1
Molar refractivity
38.78
TPSA
29.1
LogP / Solubility
WLOGP
0.72
MLOGP
0.63
XLogP3
-0.1
Consensus LogP
0.42
Log S (ESOL)
-1.16
Class (ESOL)
Soluble
Log S (Ali)
-1.22
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.16
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)
-3.06
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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