CAS RN: 2177263-82-8

(Meso-5R,8R)-8-Amino-1-Azaspiro[4.5]Decan-2-One Hydrochloride

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Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250729 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS2177263-82-8
  • Purity/Analytical Methods: >99.0%
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2177263-82-8 / 8-amino-1-azaspiro[4.5]decan-2-one;hydrochloride

Standard CAS: 2177263-82-8 Multi CAS: No

Basic Information

CAS
2177263-82-8
Multi CAS
No
Molecular Formula
C9H17ClN2O
Molecular Weight
204.700000
Exact Mass
204.102941
SMILES
C1CC2(CCC1N)CCC(=O)N2.Cl
InChI
InChI=1S/C9H16N2O.ClH/c10-7-1-4-9(5-2-7)6-3-8(12)11-9;/h7H,1-6,10H2,(H,11,12);1H
InChIKey
WVAFUSBIDBYWHP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.89
H-bond acceptors
2
H-bond donors
2
Molar refractivity
53.8
TPSA
55.12

LogP / Solubility

WLOGP
0.96
MLOGP
0.84
XLogP3
0.96
Consensus LogP
0.92
Log S (ESOL)
-1.71
Class (ESOL)
Soluble
Log S (Ali)
-1.93
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.79
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)
-3.29

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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