![CAS 1432681-74-7 8-Methyl-3-oxa-1-aza-spiro[4.5]decan-2-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1432681-74-7.gif)
CAS RN: 1432681-74-7
8-Methyl-3-oxa-1-aza-spiro[4.5]decan-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.20250619 | 10mg / 50mg | Out of stock | 30 business days | Inquiry |
- Product code: starshine_CAS1432681-74-7
- Purity/Analytical Methods: >99.0%
1432681-74-7 / 8-methyl-3-oxa-1-azaspiro[4.5]decan-2-one
Basic Information
CAS
1432681-74-7
Multi CAS
No
Molecular Formula
C9H15NO2
Molecular Weight
169.220000
Exact Mass
169.110279
SMILES
CC1CCC2(CC1)COC(=O)N2
InChI
InChI=1S/C9H15NO2/c1-7-2-4-9(5-3-7)6-12-8(11)10-9/h7H,2-6H2,1H3,(H,10,11)
InChIKey
LWZJDXHMPUQCTI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
0.89
H-bond acceptors
2
H-bond donors
1
Molar refractivity
44.85
TPSA
38.33
LogP / Solubility
WLOGP
1.68
MLOGP
1.47
XLogP3
1.6
Consensus LogP
1.58
Log S (ESOL)
-1.94
Class (ESOL)
Soluble
Log S (Ali)
-2.16
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.15
Class (SILICOS-IT)
Moderately 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)
-2.56
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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