![CAS 2200258-97-3 (S)-(5-Azaspiro[2.4]heptan-6-yl)methanol hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2200258-97-3.gif)
CAS RN: 2200258-97-3
(S)-(5-Azaspiro[2.4]heptan-6-yl)methanol hydrochloride
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.20250815 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2200258-97-3
- Purity/Analytical Methods: >99.0%
2200258-97-3 / [(6S)-5-azaspiro[2.4]heptan-6-yl]methanol;hydrochloride
Basic Information
CAS
2200258-97-3
Multi CAS
No
Molecular Formula
C7H14ClNO
Molecular Weight
163.640000
Exact Mass
163.076392
SMILES
C1CC12C[C@H](NC2)CO.Cl
InChI
InChI=1S/C7H13NO.ClH/c9-4-6-3-7(1-2-7)5-8-6;/h6,8-9H,1-5H2;1H/t6-;/m0./s1
InChIKey
YDQCMOHHMKDVML-RGMNGODLSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
42.41
TPSA
32.26
LogP / Solubility
WLOGP
0.54
MLOGP
0.47
XLogP3
0.54
Consensus LogP
0.52
Log S (ESOL)
-1.13
Class (ESOL)
Soluble
Log S (Ali)
-1.29
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.29
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)
-3.33
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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