4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide
TL;DR: 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide (CAS 854348-73-5) is a chemical compound with molecular formula C18H16N4O3S and molecular weight 368.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide
Also Known As: 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide, 4-cyano-N-[3-(4,5-dihydro-3H-pyrrol-2-ylsulfamoyl)phenyl]benzamide, 4-cyano-N-{3-[(3,4-dihydro-2H-pyrrol-5-yl)sulfamoyl]phenyl}benzamide
| Molecular Formula | C18H16N4O3S |
|---|---|
| Molecular Weight | 368.09 g/mol |
| LogP | 2.28118 |
| Topological Polar Surface Area | 111.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.0943 |
| Heavy Atoms | 26 |
| Complexity | 1005.47687 |
Chemical Identifiers
| CAS Number | 854348-73-5 |
|---|---|
| SMILES | C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C#N |
Product Overview
4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide (CAS 854348-73-5), with molecular formula C18H16N4O3S and molecular weight 368.09 g/mol. IUPAC: 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide.
Chemical Property Profile of 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide
Property Insights of 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide
The XLogP value of 2.28118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide. The TPSA of 111.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide. Following Lipinski's Rule of Five, 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide has 2 hydrogen bond donor(s) and 5 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 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide?
The CAS number of 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide is 854348-73-5.
What is the molecular formula of 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide?
The molecular formula of 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide is C18H16N4O3S.
What is the molecular weight of 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide?
The molecular weight of 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide is 368.09 g/mol.
Where can I buy 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide?
You can request a quote for 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)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-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-cyano-N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.