1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea
TL;DR: 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea (CAS 706776-90-1) is a chemical compound with molecular formula C22H22N4O3S2 and molecular weight 454.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,3-diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea
Also Known As: 1-(3,3-diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea, 2-(3,3-diphenylpropanoyl)-N-(4-sulfamoylphenyl)hydrazinecarbothioamide, 3,3-diphenyl-N-({[(4-sulfamoylphenyl)amino]thioxomethyl}amino)propanamide
| Molecular Formula | C22H22N4O3S2 |
|---|---|
| Molecular Weight | 454.11 g/mol |
| LogP | 2.8738 |
| Topological Polar Surface Area | 113.32 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.11334 |
| Heavy Atoms | 31 |
| Complexity | 1096.8932 |
Chemical Identifiers
| CAS Number | 706776-90-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CC(=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3 |
Product Overview
1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea (CAS 706776-90-1), with molecular formula C22H22N4O3S2 and molecular weight 454.11 g/mol. IUPAC: 1-(3,3-diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea.
Chemical Property Profile of 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea
Property Insights of 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea
The XLogP value of 2.8738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea. The TPSA of 113.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea. Following Lipinski's Rule of Five, 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea has 4 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 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea?
The CAS number of 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea is 706776-90-1.
What is the molecular formula of 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea?
The molecular formula of 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea is C22H22N4O3S2.
What is the molecular weight of 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea?
The molecular weight of 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea is 454.11 g/mol.
Where can I buy 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea?
You can request a quote for 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,3-Diphenylpropanoylamino)-3-(4-sulfamoylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.