CAS RN: 51256-02-1
N-(4-ACETYLPHENYL)-3-CHLOROPROPANAMIDE
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.20250725 | 250mg / 1g / 5g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS51256-02-1
- Purity/Analytical Methods: >99.0%
51256-02-1 / N-(4-acetylphenyl)-3-chloropropanamide
Basic Information
CAS
51256-02-1
Multi CAS
No
Molecular Formula
C11H12CLNO2
Molecular Weight
225.670000
Exact Mass
225.055656
InChI
InChI=1S/C11H12ClNO2/c1-8(14)9-2-4-10(5-3-9)13-11(15)6-7-12/h2-5H,6-7H2,1H3,(H,13,15)
InChIKey
CFTHHVYPCUMUNT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.27
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
1
Molar refractivity
60.41
TPSA
46.17
LogP / Solubility
WLOGP
2.46
MLOGP
2.16
XLogP3
1.8
Consensus LogP
2.14
Log S (ESOL)
-2.82
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.18
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.65
Class (SILICOS-IT)
Poorly 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)
-2.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
2-BroMo-3-Methylbutenoic Acid Methyl Ester
- CAS RN: 51263-40-2
- Product Code: starshine_CAS51263-40-2
- Purity/Analytical method: >99.0%
-
-
-
-
-
4-FORMYL-2-METHOXY-PHENOXY-ACETIC ACID ETHYL ESTER
- CAS RN: 51264-70-1
- Product Code: SSC-158085
