![1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea structure](/static/products/4361/436118-63-7.webp)
1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea
TL;DR: 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea (CAS 436118-63-7) is a chemical compound with molecular formula C17H19FN2S and molecular weight 302.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-3-(4-propan-2-ylphenyl)thiourea
Also Known As: AB01326043-02, 1-(4-fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea, 1-[(4-fluorophenyl)methyl]-3-(4-propan-2-ylphenyl)thiourea, N-(4-FLUOROBENZYL)-N'-(4-ISOPROPYLPHENYL)THIOUREA, {[(4-fluorophenyl)methyl]amino}{[4-(methylethyl)phenyl]amino}methane-1-thione
| Molecular Formula | C17H19FN2S |
|---|---|
| Molecular Weight | 302.13 g/mol |
| LogP | 4.4357 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.1253 |
| Heavy Atoms | 21 |
| Complexity | 591.1921 |
Chemical Identifiers
| CAS Number | 436118-63-7 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)F |
Product Overview
1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea (CAS 436118-63-7), with molecular formula C17H19FN2S and molecular weight 302.13 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-3-(4-propan-2-ylphenyl)thiourea.
Chemical Property Profile of 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea
Property Insights of 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea
The XLogP value of 4.4357 indicates that 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea has 2 hydrogen bond donor(s) and 1 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-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea?
The CAS number of 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea is 436118-63-7.
What is the molecular formula of 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea?
The molecular formula of 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea is C17H19FN2S.
What is the molecular weight of 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea?
The molecular weight of 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea is 302.13 g/mol.
Where can I buy 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea?
You can request a quote for 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]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-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorobenzyl)-3-[4-(propan-2-yl)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.