![4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide structure](/static/products/3031/303147-79-7.webp)
4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide
TL;DR: 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide (CAS 303147-79-7) is a chemical compound with molecular formula C20H13ClN2OS and molecular weight 364.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(3-cyano-4-phenylsulfanylphenyl)benzamide
Also Known As: ML135 Analog, Bionet1_002211, 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide, 4-chloro-N-(3-cyano-4-phenylsulfanylphenyl)benzamide, 4-chloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzamide
| Molecular Formula | C20H13ClN2OS |
|---|---|
| Molecular Weight | 364.04 g/mol |
| LogP | 5.61518 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.0437 |
| Heavy Atoms | 25 |
| Complexity | 934.16003 |
Chemical Identifiers
| CAS Number | 303147-79-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)C#N |
Product Overview
4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide (CAS 303147-79-7), with molecular formula C20H13ClN2OS and molecular weight 364.04 g/mol. IUPAC: 4-chloro-N-(3-cyano-4-phenylsulfanylphenyl)benzamide.
Chemical Property Profile of 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide
Property Insights of 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide
The XLogP value of 5.61518 indicates that 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide?
The CAS number of 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide is 303147-79-7.
What is the molecular formula of 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide?
The molecular formula of 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide is C20H13ClN2OS.
What is the molecular weight of 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide?
The molecular weight of 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide is 364.04 g/mol.
Where can I buy 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide?
You can request a quote for 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.