![1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea structure](/static/products/7019/701945-38-2.webp)
1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea
TL;DR: 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea (CAS 701945-38-2) is a chemical compound with molecular formula C14H14N4O4S2 and molecular weight 366.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea
Also Known As: 1-[4-(methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea, N-methyl-4-{[(3-nitrophenyl)carbamothioyl]amino}benzenesulfonamide, methyl{[4-({[(3-nitrophenyl)amino]thioxomethyl}amino)phenyl]sulfonyl}amine
| Molecular Formula | C14H14N4O4S2 |
|---|---|
| Molecular Weight | 366.05 g/mol |
| LogP | 2.3118 |
| Topological Polar Surface Area | 113.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.04565 |
| Heavy Atoms | 24 |
| Complexity | 866.5981 |
Chemical Identifiers
| CAS Number | 701945-38-2 |
|---|---|
| SMILES | CNS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea (CAS 701945-38-2), with molecular formula C14H14N4O4S2 and molecular weight 366.05 g/mol. IUPAC: 1-[4-(methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea.
Chemical Property Profile of 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea
Property Insights of 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea
The XLogP value of 2.3118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea. The TPSA of 113.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea. Following Lipinski's Rule of Five, 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea has 3 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 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea?
The CAS number of 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea is 701945-38-2.
What is the molecular formula of 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea?
The molecular formula of 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea is C14H14N4O4S2.
What is the molecular weight of 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea?
The molecular weight of 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea is 366.05 g/mol.
Where can I buy 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea?
You can request a quote for 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(Methylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.