N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea
TL;DR: N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea (CAS 445418-51-9) is a chemical compound with molecular formula C17H17FN2OS and molecular weight 316.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-N-[(4-propan-2-ylphenyl)carbamothioyl]benzamide
Also Known As: N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea, 2-fluoro-N-[(4-propan-2-ylphenyl)carbamothioyl]benzamide, AN-465/41164535, 2-fluoro-N-{[4-(propan-2-yl)phenyl]carbamothioyl}benzamide, N-(2-Fluorobenzoyl)-N/'-(4-isopropylphenyl)thiourea
| Molecular Formula | C17H17FN2OS |
|---|---|
| Molecular Weight | 316.10 g/mol |
| LogP | 4.0759 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.10455 |
| Heavy Atoms | 22 |
| Complexity | 683.31323 |
Chemical Identifiers
| CAS Number | 445418-51-9 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2F |
Product Overview
N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea (CAS 445418-51-9), with molecular formula C17H17FN2OS and molecular weight 316.10 g/mol. IUPAC: 2-fluoro-N-[(4-propan-2-ylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea
Property Insights of N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea
The XLogP value of 4.0759 indicates that N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea has 2 hydrogen bond donor(s) and 2 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-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea?
The CAS number of N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea is 445418-51-9.
What is the molecular formula of N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea?
The molecular formula of N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea is C17H17FN2OS.
What is the molecular weight of N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea?
The molecular weight of N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea is 316.10 g/mol.
Where can I buy N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea?
You can request a quote for N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2-fluorobenzoyl)-N'-(4-isopropylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.