3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide
TL;DR: 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide (CAS 303147-70-8) is a chemical compound with molecular formula C20H12Cl2N2OS and molecular weight 398.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichloro-N-(3-cyano-4-phenylsulfanylphenyl)benzamide
Also Known As: Bionet1_002207, 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide, 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzamide, 11K-615S, 3,4-dichloro-N-(3-cyano-4-phenylsulfanylphenyl)benzamide
| Molecular Formula | C20H12Cl2N2OS |
|---|---|
| Molecular Weight | 398.00 g/mol |
| LogP | 6.26858 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.00473 |
| Heavy Atoms | 26 |
| Complexity | 1000.4382 |
Chemical Identifiers
| CAS Number | 303147-70-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)Cl)C#N |
Product Overview
3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide (CAS 303147-70-8), with molecular formula C20H12Cl2N2OS and molecular weight 398.00 g/mol. IUPAC: 3,4-dichloro-N-(3-cyano-4-phenylsulfanylphenyl)benzamide.
Chemical Property Profile of 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide
Property Insights of 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide
The XLogP value of 6.26858 indicates that 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide 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 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide?
The CAS number of 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide is 303147-70-8.
What is the molecular formula of 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide?
The molecular formula of 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide is C20H12Cl2N2OS.
What is the molecular weight of 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide?
The molecular weight of 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide is 398.00 g/mol.
Where can I buy 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide?
You can request a quote for 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dichloro-N-[3-cyano-4-(phenylsulfanyl)phenyl]benzenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.