1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea
TL;DR: 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea (CAS 200629-13-6) is a chemical compound with molecular formula C15H15N3O3S and molecular weight 317.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea
Also Known As: 1-(2-hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea, N-(2-hydroxy-1-phenylethyl)-N'-(4-nitrophenyl)thiourea, 4N-078, 1-(2-hydroxy-1-phenyl-ethyl)-3-(4-nitrophenyl)thiourea
| Molecular Formula | C15H15N3O3S |
|---|---|
| Molecular Weight | 317.08 g/mol |
| LogP | 2.6148 |
| Topological Polar Surface Area | 87.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 317.0834 |
| Heavy Atoms | 22 |
| Complexity | 646.84204 |
Chemical Identifiers
| CAS Number | 200629-13-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CO)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea (CAS 200629-13-6), with molecular formula C15H15N3O3S and molecular weight 317.08 g/mol. IUPAC: 1-(2-hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea.
Chemical Property Profile of 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea
Property Insights of 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea
The XLogP value of 2.6148 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea. The TPSA of 87.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea. Following Lipinski's Rule of Five, 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea has 3 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-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea?
The CAS number of 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea is 200629-13-6.
What is the molecular formula of 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea?
The molecular formula of 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea is C15H15N3O3S.
What is the molecular weight of 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea?
The molecular weight of 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea is 317.08 g/mol.
Where can I buy 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea?
You can request a quote for 1-(2-Hydroxy-1-phenylethyl)-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-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Hydroxy-1-phenylethyl)-3-(4-nitrophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.