N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide
TL;DR: N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide (CAS 1008665-37-9) is a chemical compound with molecular formula C23H19N3O2S and molecular weight 401.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide
Also Known As: TimTec1_006513, A3315/0140919, Nalpha-({2-[(2-cyanophenyl)sulfanyl]phenyl}carbonyl)phenylalaninamide, N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide, N-(1-carbamoyl-2-phenylethyl)[2-(2-cyanophenylthio)phenyl]carboxamide
| Molecular Formula | C23H19N3O2S |
|---|---|
| Molecular Weight | 401.12 g/mol |
| LogP | 3.53588 |
| Topological Polar Surface Area | 95.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 401.1198 |
| Heavy Atoms | 29 |
| Complexity | 1060.973 |
Chemical Identifiers
| CAS Number | 1008665-37-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)N)NC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N |
Product Overview
N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide (CAS 1008665-37-9), with molecular formula C23H19N3O2S and molecular weight 401.12 g/mol. IUPAC: N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide.
Chemical Property Profile of N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide
Property Insights of N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide
The XLogP value of 3.53588 indicates that N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.98 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide. Following Lipinski's Rule of Five, N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide?
The CAS number of N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide is 1008665-37-9.
What is the molecular formula of N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide?
The molecular formula of N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide is C23H19N3O2S.
What is the molecular weight of N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide?
The molecular weight of N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide is 401.12 g/mol.
Where can I buy N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide?
You can request a quote for N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-(2-cyanophenyl)sulfanylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.