CAS RN: 753391-71-8
4-Azepan-1-yl-butyric acid
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250421 | 100mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250201 | 1g | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20251012 | 250mg | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260420 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS753391-71-8
- Purity/Analytical Methods: >99.0%
753391-71-8 / 4-(azepan-1-yl)butanoic acid
Basic Information
CAS
753391-71-8
Multi CAS
Yes
Molecular Formula
C10H19NO2
Molecular Weight
185.260000
Exact Mass
185.141579
InChI
InChI=1S/C10H19NO2/c12-10(13)6-5-9-11-7-3-1-2-4-8-11/h1-9H2,(H,12,13)
InChIKey
GFGARPFCEPBBDN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.9
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
1
Molar refractivity
51.78
TPSA
40.54
LogP / Solubility
WLOGP
1.73
MLOGP
1.52
XLogP3
-1
Consensus LogP
0.75
Log S (ESOL)
-1.81
Class (ESOL)
Soluble
Log S (Ali)
-2.33
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.78
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)
-2.62
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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