CAS RN: 57357-56-9
AC-D-NVA-OH
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.20250826 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS57357-56-9
- Purity/Analytical Methods: >99.0%
57357-56-9 / 2-acetamidopentanoic acid
Basic Information
CAS
57357-56-9
Multi CAS
Yes
Molecular Formula
C7H13NO3
Molecular Weight
159.180000
Exact Mass
159.089543
InChI
InChI=1S/C7H13NO3/c1-3-4-6(7(10)11)8-5(2)9/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)/t6-/m1/s1
InChIKey
BSYFPUSAWVWWDG-ZCFIWIBFSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.71
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
2
Molar refractivity
40.15
TPSA
66.4
LogP / Solubility
WLOGP
0.38
MLOGP
0.33
XLogP3
0.2
Consensus LogP
0.3
Log S (ESOL)
-0.8
Class (ESOL)
Very soluble
Log S (Ali)
-1.14
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.49
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)
-3.42
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
Dihydroepistephamiersine 6-acetate
- CAS RN: 57361-74-7
- Product Code: starshine_CAS57361-74-7
- Purity/Analytical method: >99.0%
-
-
1H-1,2,3-Triazole-4-carboxylicacid,1-methyl-,methylester(9CI)
- CAS RN: 57362-82-0
- Product Code: SSC-165479
-
-
-
3-(4-(Benzyloxy)-3-Methoxyphenyl)propan-1-ol
- CAS RN: 57371-44-5
- Product Code: starshine_CAS57371-44-5
- Purity/Analytical method: >99.0%
