CAS RN: 915795-01-6

7-AMINO-7-METHYL-5-AZASPIRO[2.4]HEPTAN-4-ONE HCL

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Batchno.20250506 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS915795-01-6
  • Purity/Analytical Methods: >99.0%
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915795-01-6 / 7-amino-7-methyl-5-azaspiro[2.4]heptan-4-one;hydrochloride

Standard CAS: 915795-01-6 Multi CAS: Yes

Basic Information

CAS
915795-01-6
Multi CAS
Yes
Molecular Formula
C7H13CLN2O
Molecular Weight
176.640000
Exact Mass
176.071641
InChI
InChI=1S/C7H12N2O.ClH/c1-6(8)4-9-5(10)7(6)2-3-7;/h2-4,8H2,1H3,(H,9,10);1H
InChIKey
IPZKXNFEZLOBCZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.86
H-bond acceptors
2
H-bond donors
2
Molar refractivity
44.52
TPSA
55.12

LogP / Solubility

WLOGP
0.04
MLOGP
0.03
XLogP3
0.04
Consensus LogP
0.04
Log S (ESOL)
-0.96
Class (ESOL)
Very soluble
Log S (Ali)
-1.03
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.84
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)
-3.77

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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