1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea
TL;DR: 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea (CAS 708237-22-3) is a chemical compound with molecular formula C15H14ClN5O4S and molecular weight 395.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea
Also Known As: 1-[(4-chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea, (2-{[(4-chlorophenyl)amino]thioxomethyl}hydrazino)-N-(2-methoxy-4-nitrophenyl) carboxamide, 2-[(4-chlorophenyl)carbamothioyl]-N-(2-methoxy-4-nitrophenyl)hydrazinecarboxamide
| Molecular Formula | C15H14ClN5O4S |
|---|---|
| Molecular Weight | 395.05 g/mol |
| LogP | 3.2799 |
| Topological Polar Surface Area | 117.56 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 395.0455 |
| Heavy Atoms | 26 |
| Complexity | 831.2865 |
Chemical Identifiers
| CAS Number | 708237-22-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)NNC(=S)NC2=CC=C(C=C2)Cl |
Product Overview
1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea (CAS 708237-22-3), with molecular formula C15H14ClN5O4S and molecular weight 395.05 g/mol. IUPAC: 1-[(4-chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea.
Chemical Property Profile of 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea
Property Insights of 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea
The XLogP value of 3.2799 indicates that 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea. Following Lipinski's Rule of Five, 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea has 4 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-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea?
The CAS number of 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea is 708237-22-3.
What is the molecular formula of 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea?
The molecular formula of 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea is C15H14ClN5O4S.
What is the molecular weight of 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea?
The molecular weight of 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea is 395.05 g/mol.
Where can I buy 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea?
You can request a quote for 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Chlorophenyl)carbamothioylamino]-3-(2-methoxy-4-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.