![1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea structure](/static/products/900/900701-83-9.png)
1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea
TL;DR: 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea (CAS 900701-83-9) is a chemical compound with molecular formula C14H12ClN3O2S and molecular weight 321.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea
Also Known As: InhA-IN-3, 1-[(2-chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea, 1-(2-chlorophenyl)methyl)-3-(4-nitrophenyl)thiourea, 1-(2-Chlorobenzyl)-3-(4-nitrophenyl)thiourea, 1-(2-Chlorophenyl)methyl-3-(4-nitrophenyl)thiourea
| Molecular Formula | C14H12ClN3O2S |
|---|---|
| Molecular Weight | 321.03 g/mol |
| LogP | 3.7348 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.03387 |
| Heavy Atoms | 21 |
| Complexity | 661.5236 |
Chemical Identifiers
| CAS Number | 900701-83-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Cl |
Product Overview
1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea (CAS 900701-83-9), with molecular formula C14H12ClN3O2S and molecular weight 321.03 g/mol. IUPAC: 1-[(2-chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea.
Chemical Property Profile of 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea
Property Insights of 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea
The XLogP value of 3.7348 indicates that 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea. Following Lipinski's Rule of Five, 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea has 2 hydrogen bond donor(s) and 3 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-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea?
The CAS number of 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea is 900701-83-9.
What is the molecular formula of 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea?
The molecular formula of 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea is C14H12ClN3O2S.
What is the molecular weight of 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea?
The molecular weight of 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea is 321.03 g/mol.
Where can I buy 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea?
You can request a quote for 1-[(2-Chlorophenyl)methyl]-3-(4-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-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Chlorophenyl)methyl]-3-(4-nitrophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.