1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea
TL;DR: 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea (CAS 53385-93-6) is a chemical compound with molecular formula C13H11Cl2N3S and molecular weight 311.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)-3-(3-methyl-2-pyridinyl)thiourea
Also Known As: 1-(3,4-dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea, N-(3,4-dichlorophenyl)-N'-(3-methyl-2-pyridinyl)thiourea, [(3,4-dichlorophenyl)amino][(3-methyl(2-pyridyl))amino]methane-1-thione
| Molecular Formula | C13H11Cl2N3S |
|---|---|
| Molecular Weight | 311.01 g/mol |
| LogP | 4.50572 |
| Topological Polar Surface Area | 36.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 311.00507 |
| Heavy Atoms | 19 |
| Complexity | 616.58734 |
Chemical Identifiers
| CAS Number | 53385-93-6 |
|---|---|
| SMILES | CC1=C(N=CC=C1)NC(=S)NC2=CC(=C(C=C2)Cl)Cl |
Product Overview
1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea (CAS 53385-93-6), with molecular formula C13H11Cl2N3S and molecular weight 311.01 g/mol. IUPAC: 1-(3,4-dichlorophenyl)-3-(3-methyl-2-pyridinyl)thiourea.
Chemical Property Profile of 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea
Property Insights of 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea
The XLogP value of 4.50572 indicates that 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.95 Ų, 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)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-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea?
The CAS number of 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea is 53385-93-6.
What is the molecular formula of 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea?
The molecular formula of 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea is C13H11Cl2N3S.
What is the molecular weight of 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea?
The molecular weight of 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea is 311.01 g/mol.
Where can I buy 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea?
You can request a quote for 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dichlorophenyl)-3-(3-methylpyridin-2-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.