1-(4-Nitrophenyl)-3-phenyl-2-thiourea
TL;DR: 1-(4-Nitrophenyl)-3-phenyl-2-thiourea (CAS 7669-49-0) is a chemical compound with molecular formula C13H11N3O2S and molecular weight 273.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-3-phenylthiourea
Also Known As: 1-(4-Nitrophenyl)-3-phenyl-2-thiourea, 1-(4-nitrophenyl)-3-phenylthiourea, N-(4-nitrophenyl)-N'-phenylthiourea, 1-(4-nitrophenyl)-3-phenyl thiourea, 1-(4-nitrophenyl)-3-phenyl-thiourea
| Molecular Formula | C13H11N3O2S |
|---|---|
| Molecular Weight | 273.06 g/mol |
| LogP | 3.4037 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.0572 |
| Heavy Atoms | 19 |
| Complexity | 584.59717 |
Chemical Identifiers
| CAS Number | 7669-49-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
1-(4-Nitrophenyl)-3-phenyl-2-thiourea (CAS 7669-49-0), with molecular formula C13H11N3O2S and molecular weight 273.06 g/mol. IUPAC: 1-(4-nitrophenyl)-3-phenylthiourea.
Chemical Property Profile of 1-(4-Nitrophenyl)-3-phenyl-2-thiourea
Property Insights of 1-(4-Nitrophenyl)-3-phenyl-2-thiourea
The XLogP value of 3.4037 indicates that 1-(4-Nitrophenyl)-3-phenyl-2-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-(4-Nitrophenyl)-3-phenyl-2-thiourea. Following Lipinski's Rule of Five, 1-(4-Nitrophenyl)-3-phenyl-2-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-(4-Nitrophenyl)-3-phenyl-2-thiourea?
The CAS number of 1-(4-Nitrophenyl)-3-phenyl-2-thiourea is 7669-49-0.
What is the molecular formula of 1-(4-Nitrophenyl)-3-phenyl-2-thiourea?
The molecular formula of 1-(4-Nitrophenyl)-3-phenyl-2-thiourea is C13H11N3O2S.
What is the molecular weight of 1-(4-Nitrophenyl)-3-phenyl-2-thiourea?
The molecular weight of 1-(4-Nitrophenyl)-3-phenyl-2-thiourea is 273.06 g/mol.
Where can I buy 1-(4-Nitrophenyl)-3-phenyl-2-thiourea?
You can request a quote for 1-(4-Nitrophenyl)-3-phenyl-2-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-Nitrophenyl)-3-phenyl-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Nitrophenyl)-3-phenyl-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.