N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea
TL;DR: N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea (CAS 6291-53-8) is a chemical compound with molecular formula C13H10FN3O3S and molecular weight 307.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-3-(2-hydroxy-4-nitrophenyl)thiourea
Also Known As: BIM-0015595.P001, 1-(4-fluorophenyl)-3-(2-hydroxy-4-nitrophenyl)thiourea, N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea
| Molecular Formula | C13H10FN3O3S |
|---|---|
| Molecular Weight | 307.04 g/mol |
| LogP | 3.2484 |
| Topological Polar Surface Area | 87.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.0427 |
| Heavy Atoms | 21 |
| Complexity | 691.56085 |
Chemical Identifiers
| CAS Number | 6291-53-8 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])O)F |
Product Overview
N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea (CAS 6291-53-8), with molecular formula C13H10FN3O3S and molecular weight 307.04 g/mol. IUPAC: 1-(4-fluorophenyl)-3-(2-hydroxy-4-nitrophenyl)thiourea.
Chemical Property Profile of N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea
Property Insights of N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea
The XLogP value of 3.2484 indicates that N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.43 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea. Following Lipinski's Rule of Five, N-(4-fluorophenyl)-N'-(2-hydroxy-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 N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea?
The CAS number of N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea is 6291-53-8.
What is the molecular formula of N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea?
The molecular formula of N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea is C13H10FN3O3S.
What is the molecular weight of N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea?
The molecular weight of N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea is 307.04 g/mol.
Where can I buy N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea?
You can request a quote for N-(4-fluorophenyl)-N'-(2-hydroxy-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 N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluorophenyl)-N'-(2-hydroxy-4-nitrophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.