1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea
TL;DR: 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea (CAS 287918-60-9) is a chemical compound with molecular formula C15H16ClN3S and molecular weight 305.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]-3-methyl-1-(pyridin-3-ylmethyl)thiourea
Also Known As: 1-(4-chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea, 1-[(4-chlorophenyl)methyl]-3-methyl-1-(pyridin-3-ylmethyl)thiourea, N-(4-Chlorobenzyl)-N'-methyl-N-(3-pyridinylmethyl)thiourea #, N-(4-Chlorobenzyl)-N'-methyl-N-(pyridin-3-ylmethyl)thiourea, {[(4-chlorophenyl)methyl](3-pyridylmethyl)amino}(methylamino)methane-1-thione
| Molecular Formula | C15H16ClN3S |
|---|---|
| Molecular Weight | 305.08 g/mol |
| LogP | 3.2415 |
| Topological Polar Surface Area | 28.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.07535 |
| Heavy Atoms | 20 |
| Complexity | 557.0911 |
Chemical Identifiers
| CAS Number | 287918-60-9 |
|---|---|
| SMILES | CNC(=S)N(CC1=CC=C(C=C1)Cl)CC2=CN=CC=C2 |
Product Overview
1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea (CAS 287918-60-9), with molecular formula C15H16ClN3S and molecular weight 305.08 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]-3-methyl-1-(pyridin-3-ylmethyl)thiourea.
Chemical Property Profile of 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea
Property Insights of 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea
The XLogP value of 3.2415 indicates that 1-(4-Chlorobenzyl)-3-methyl-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 28.16 Ų, 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea has 1 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 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea?
The CAS number of 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea is 287918-60-9.
What is the molecular formula of 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea?
The molecular formula of 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea is C15H16ClN3S.
What is the molecular weight of 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea?
The molecular weight of 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea is 305.08 g/mol.
Where can I buy 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea?
You can request a quote for 1-(4-Chlorobenzyl)-3-methyl-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-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorobenzyl)-3-methyl-1-(pyridin-3-ylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.