((3-Chlorophenyl)amino)thiourea
TL;DR: ((3-Chlorophenyl)amino)thiourea (CAS 828-11-5) is a chemical compound with molecular formula C7H8ClN3S and molecular weight 201.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloroanilino)thiourea
Also Known As: [(3-chlorophenyl)amino]thiourea|(3-chloroanilino)thiourea|2-(3-chlorophenyl)-1-hydrazinecarbothioamide|m-chlorophenylthiosemicarbazide|((3-Chlorophenyl)amino)thiourea|KS-00001UQE|(3-CHLOROPHENYL)AMINOTHIOUREA|2-(3-chlorophenyl)hydrazinecarbothioamide|Hydrazinecarbothioamide, 2-(3-chlorophenyl)-|981-290-4|RefChem:390001|MFCD00456274|MLS000541353|SMR000126211|EN300-399765
| Molecular Formula | C7H8ClN3S |
|---|---|
| Molecular Weight | 201.01 g/mol |
| LogP | 1.5001 |
| Topological Polar Surface Area | 50.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.01274 |
| Heavy Atoms | 12 |
| Complexity | 289.7349 |
Chemical Identifiers
| CAS Number | 828-11-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NNC(=S)N |
Product Overview
((3-Chlorophenyl)amino)thiourea (CAS 828-11-5), with molecular formula C7H8ClN3S and molecular weight 201.01 g/mol. IUPAC: (3-chloroanilino)thiourea.
Chemical Property Profile of ((3-Chlorophenyl)amino)thiourea
Property Insights of ((3-Chlorophenyl)amino)thiourea
The XLogP value of 1.5001 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((3-Chlorophenyl)amino)thiourea. With a topological polar surface area (TPSA) of 50.08 Ų, ((3-Chlorophenyl)amino)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((3-Chlorophenyl)amino)thiourea has 3 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 ((3-Chlorophenyl)amino)thiourea?
The CAS number of ((3-Chlorophenyl)amino)thiourea is 828-11-5.
What is the molecular formula of ((3-Chlorophenyl)amino)thiourea?
The molecular formula of ((3-Chlorophenyl)amino)thiourea is C7H8ClN3S.
What is the molecular weight of ((3-Chlorophenyl)amino)thiourea?
The molecular weight of ((3-Chlorophenyl)amino)thiourea is 201.01 g/mol.
Where can I buy ((3-Chlorophenyl)amino)thiourea?
You can request a quote for ((3-Chlorophenyl)amino)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((3-Chlorophenyl)amino)thiourea?
Yes, KEHONG BIO provides custom synthesis services for ((3-Chlorophenyl)amino)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.