CAS RN: 2177266-26-9
Meso-(5S,8S)-8-Amino-1-Azaspiro[4.5]Decan-2-One Hydrochloride(WX100113S1)
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20260522 |
100mg / 250mg / 1g |
Out of stock |
5-7 business days | Inquiry |
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Product code:
starshine_CAS2177266-26-9
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Purity/Analytical Methods:
>99.0%
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2177266-26-9 / 8-amino-1-azaspiro[4.5]decan-2-one;hydrochloride
Standard CAS: 2177266-26-9
Multi CAS: No
Basic Information
CAS
2177266-26-9
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