1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea
TL;DR: 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea (CAS 433256-81-6) is a chemical compound with molecular formula C15H17N3S and molecular weight 271.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea
Also Known As: Maybridge1_003697, 1-(2,4-dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea, N-(2,4-dimethylphenyl)-N'-(3-pyridylmethyl)thiourea, N-(2,4-dimethylphenyl)-N'-(pyridin-3-ylmethyl)thiourea, [(2,4-dimethylphenyl)amino][(3-pyridylmethyl)amino]methane-1-thione
| Molecular Formula | C15H17N3S |
|---|---|
| Molecular Weight | 271.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 69.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.11432 |
| Heavy Atoms | 19 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 433256-81-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=S)NCC2=CN=CC=C2)C |
| InChIKey | FYYOQHQXPVUCOZ-UHFFFAOYSA-N |
Product Overview
1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea (CAS 433256-81-6), with molecular formula C15H17N3S and molecular weight 271.11 g/mol. IUPAC: 1-(2,4-dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea.
Chemical Property Profile of 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea
Property Insights of 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea. The TPSA of 69.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea. Following Lipinski's Rule of Five, 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)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 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea?
The CAS number of 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea is 433256-81-6.
What is the molecular formula of 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea?
The molecular formula of 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea is C15H17N3S.
What is the molecular weight of 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea?
The molecular weight of 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea is 271.11 g/mol.
Where can I buy 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea?
You can request a quote for 1-(2,4-Dimethylphenyl)-3-(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-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dimethylphenyl)-3-(pyridin-3-ylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.