1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea
TL;DR: 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea (CAS 6290-12-6) is a chemical compound with molecular formula C22H22FN3OS and molecular weight 395.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea
Also Known As: 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea, 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea, N-[(4-Fluorophenyl)methyl]-N'-(2-methoxy-4-methylphenyl)-N-[(pyridin-3-yl)methyl]thiourea
| Molecular Formula | C22H22FN3OS |
|---|---|
| Molecular Weight | 395.15 g/mol |
| LogP | 4.93692 |
| Topological Polar Surface Area | 37.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.14676 |
| Heavy Atoms | 28 |
| Complexity | 932.2717 |
Chemical Identifiers
| CAS Number | 6290-12-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)F)CC3=CN=CC=C3)OC |
Product Overview
1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea (CAS 6290-12-6), with molecular formula C22H22FN3OS and molecular weight 395.15 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea.
Chemical Property Profile of 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea
Property Insights of 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea
The XLogP value of 4.93692 indicates that 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.39 Ų, 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea has 1 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-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea?
The CAS number of 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea is 6290-12-6.
What is the molecular formula of 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea?
The molecular formula of 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea is C22H22FN3OS.
What is the molecular weight of 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea?
The molecular weight of 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea is 395.15 g/mol.
Where can I buy 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea?
You can request a quote for 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)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-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.