![4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide structure](/static/products/4942/494219-29-3.webp)
4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide
TL;DR: 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide (CAS 494219-29-3) is a chemical compound with molecular formula C13H13ClN4O2S and molecular weight 324.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-1,3-dimethylpyrazole-5-carboxamide
Also Known As: 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide, 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide, N-[(4-chloro-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]-N'-(3-hydroxyphenyl)thiourea, 4-chloro-N-[(3-hydroxyphenyl)thiocarbamoyl]-2,5-dimethyl-pyrazole-3-carboxamide
| Molecular Formula | C13H13ClN4O2S |
|---|---|
| Molecular Weight | 324.04 g/mol |
| LogP | 2.21432 |
| Topological Polar Surface Area | 79.18 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.04477 |
| Heavy Atoms | 21 |
| Complexity | 714.19196 |
Chemical Identifiers
| CAS Number | 494219-29-3 |
|---|---|
| SMILES | CC1=NN(C(=C1Cl)C(=O)NC(=S)NC2=CC(=CC=C2)O)C |
Product Overview
4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide (CAS 494219-29-3), with molecular formula C13H13ClN4O2S and molecular weight 324.04 g/mol. IUPAC: 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-1,3-dimethylpyrazole-5-carboxamide.
Chemical Property Profile of 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide
Property Insights of 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide
The XLogP value of 2.21432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide. The TPSA of 79.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide has 3 hydrogen bond donor(s) and 4 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 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
The CAS number of 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is 494219-29-3.
What is the molecular formula of 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
The molecular formula of 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is C13H13ClN4O2S.
What is the molecular weight of 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
The molecular weight of 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide is 324.04 g/mol.
Where can I buy 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
You can request a quote for 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.