2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide
TL;DR: 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide (CAS 512810-35-4) is a chemical compound with molecular formula C12H11Cl2N5OS and molecular weight 343.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chloro-1-methylpyrazole-3-carbonyl)amino]-3-(3-chlorophenyl)thiourea
Also Known As: 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide, 1-[(4-chloro-1-methylpyrazole-3-carbonyl)amino]-3-(3-chlorophenyl)thiourea, 1-[(4-chloranyl-1-methyl-pyrazol-3-yl)carbonylamino]-3-(3-chlorophenyl)thiourea, 1-[(4-chloro-1-methyl-pyrazole-3-carbonyl)amino]-3-(3-chlorophenyl)thiourea, 1-[[(4-chloro-1-methyl-3-pyrazolyl)-oxomethyl]amino]-3-(3-chlorophenyl)thiourea
| Molecular Formula | C12H11Cl2N5OS |
|---|---|
| Molecular Weight | 343.01 g/mol |
| LogP | 2.3583 |
| Topological Polar Surface Area | 70.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.00613 |
| Heavy Atoms | 21 |
| Complexity | 688.03735 |
Chemical Identifiers
| CAS Number | 512810-35-4 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)NNC(=S)NC2=CC(=CC=C2)Cl)Cl |
Product Overview
2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide (CAS 512810-35-4), with molecular formula C12H11Cl2N5OS and molecular weight 343.01 g/mol. IUPAC: 1-[(4-chloro-1-methylpyrazole-3-carbonyl)amino]-3-(3-chlorophenyl)thiourea.
Chemical Property Profile of 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide
Property Insights of 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide
The XLogP value of 2.3583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide. The TPSA of 70.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide has 3 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 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide?
The CAS number of 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide is 512810-35-4.
What is the molecular formula of 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide?
The molecular formula of 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide is C12H11Cl2N5OS.
What is the molecular weight of 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide?
The molecular weight of 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide is 343.01 g/mol.
Where can I buy 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide?
You can request a quote for 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-N-(3-chlorophenyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.