N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
TL;DR: N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide (CAS 1187058-38-3) is a chemical compound with molecular formula C19H15ClN4O2S and molecular weight 398.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-chloro-1,3-benzothiazol-2-yl)-3-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-5-carboxamide
Also Known As: N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide, N-(6-Chloro-2-benzothiazolyl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide, (5Z)-N-(6-chloro-1,3-benzothiazol-2-yl)-5-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide, N-(6-chloro-1,3-benzothiazol-2-yl)-5-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide, N-(6-chlorobenzo[d]thiazol-2-yl)-3-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-5-carboxamide
| Molecular Formula | C19H15ClN4O2S |
|---|---|
| Molecular Weight | 398.06 g/mol |
| LogP | 4.91454 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.06042 |
| Heavy Atoms | 27 |
| Complexity | 1181.8881 |
Chemical Identifiers
| CAS Number | 1187058-38-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C2=NNC(=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl)O)C |
Product Overview
N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide (CAS 1187058-38-3), with molecular formula C19H15ClN4O2S and molecular weight 398.06 g/mol. IUPAC: N-(6-chloro-1,3-benzothiazol-2-yl)-3-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-5-carboxamide.
Chemical Property Profile of N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
Property Insights of N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
The XLogP value of 4.91454 indicates that N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide. Following Lipinski's Rule of Five, N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide has 3 hydrogen bond donor(s) and 5 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-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide?
The CAS number of N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide is 1187058-38-3.
What is the molecular formula of N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide?
The molecular formula of N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide is C19H15ClN4O2S.
What is the molecular weight of N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide?
The molecular weight of N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide is 398.06 g/mol.
Where can I buy N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide?
You can request a quote for N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-chloro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.