1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea
TL;DR: 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea (CAS 77992-03-1) is a chemical compound with molecular formula C10H13ClN2O2S and molecular weight 260.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-2,4-dimethoxyphenyl)-3-methylthiourea
Also Known As: 1-(5-chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea, 1-(5-chloro-2,4-dimethoxyphenyl)-3-methylthiourea, N-(5-CHLORO-2,4-DIMETHOXYPHENYL)-N'-METHYLTHIOUREA, 668-682-8, RefChem:426354
| Molecular Formula | C10H13ClN2O2S |
|---|---|
| Molecular Weight | 260.04 g/mol |
| LogP | 2.2734 |
| Topological Polar Surface Area | 42.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.03864 |
| Heavy Atoms | 16 |
| Complexity | 398.65057 |
Chemical Identifiers
| CAS Number | 77992-03-1 |
|---|---|
| SMILES | CNC(=S)NC1=CC(=C(C=C1OC)OC)Cl |
Product Overview
1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea (CAS 77992-03-1), with molecular formula C10H13ClN2O2S and molecular weight 260.04 g/mol. IUPAC: 1-(5-chloro-2,4-dimethoxyphenyl)-3-methylthiourea.
Chemical Property Profile of 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea
Property Insights of 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea
The XLogP value of 2.2734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea. With a topological polar surface area (TPSA) of 42.52 Ų, 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea has 2 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-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea?
The CAS number of 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea is 77992-03-1.
What is the molecular formula of 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea?
The molecular formula of 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea is C10H13ClN2O2S.
What is the molecular weight of 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea?
The molecular weight of 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea is 260.04 g/mol.
Where can I buy 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea?
You can request a quote for 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Chloro-2,4-dimethoxyphenyl)-3-methyl-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.