N-(3-Chloro-4-methylphenyl)thiourea
TL;DR: N-(3-Chloro-4-methylphenyl)thiourea (CAS 117174-84-2) is a chemical compound with molecular formula C8H9ClN2S and molecular weight 200.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-4-methylphenyl)thiourea
Also Known As: 1-(3-chloro-4-methylphenyl)thiourea, 1-(3-Chloro-4-methylphenyl)-2-thiourea, (3-chloro-4-methylphenyl)thiourea, Thiourea, N-(3-chloro-4-methylphenyl)-, 3-chloro-4-methylphenylthiourea
| Molecular Formula | C8H9ClN2S |
|---|---|
| Molecular Weight | 200.02 g/mol |
| LogP | 2.30392 |
| Topological Polar Surface Area | 38.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.0175 |
| Heavy Atoms | 12 |
| Complexity | 311.9262 |
Chemical Identifiers
| CAS Number | 117174-84-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=S)N)Cl |
Product Overview
N-(3-Chloro-4-methylphenyl)thiourea (CAS 117174-84-2), with molecular formula C8H9ClN2S and molecular weight 200.02 g/mol. IUPAC: (3-chloro-4-methylphenyl)thiourea.
Chemical Property Profile of N-(3-Chloro-4-methylphenyl)thiourea
Property Insights of N-(3-Chloro-4-methylphenyl)thiourea
The XLogP value of 2.30392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Chloro-4-methylphenyl)thiourea. With a topological polar surface area (TPSA) of 38.05 Ų, N-(3-Chloro-4-methylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Chloro-4-methylphenyl)thiourea has 2 hydrogen bond donor(s) and 1 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 N-(3-Chloro-4-methylphenyl)thiourea?
The CAS number of N-(3-Chloro-4-methylphenyl)thiourea is 117174-84-2.
What is the molecular formula of N-(3-Chloro-4-methylphenyl)thiourea?
The molecular formula of N-(3-Chloro-4-methylphenyl)thiourea is C8H9ClN2S.
What is the molecular weight of N-(3-Chloro-4-methylphenyl)thiourea?
The molecular weight of N-(3-Chloro-4-methylphenyl)thiourea is 200.02 g/mol.
Where can I buy N-(3-Chloro-4-methylphenyl)thiourea?
You can request a quote for N-(3-Chloro-4-methylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Chloro-4-methylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Chloro-4-methylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.