3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole
TL;DR: 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole (CAS 77935-72-9) is a chemical compound with molecular formula C11H10ClN3O3 and molecular weight 267.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole-3-carboxamide
Also Known As: 3-CB-Chp-5-MP, 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole, 1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole-3-carboxamide, 1-(3-Chloro-4-hydroxyphenyl)-5-methoxy-1H-pyrazole-3-carboxamide, 1H-Pyrazole-3-carboxamide, 1-(3-chloro-4-hydroxyphenyl)-5-methoxy-
| Molecular Formula | C11H10ClN3O3 |
|---|---|
| Molecular Weight | 267.04 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 90.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.04108 |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 77935-72-9 |
|---|---|
| SMILES | COC1=CC(=NN1C2=CC(=C(C=C2)O)Cl)C(=O)N |
| InChIKey | IAGPLHFYMJKFTJ-UHFFFAOYSA-N |
Product Overview
3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole (CAS 77935-72-9), with molecular formula C11H10ClN3O3 and molecular weight 267.04 g/mol. IUPAC: 1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole-3-carboxamide.
Chemical Property Profile of 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole
Property Insights of 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole. The TPSA of 90.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole. Following Lipinski's Rule of Five, 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole has 2 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 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole?
The CAS number of 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole is 77935-72-9.
What is the molecular formula of 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole?
The molecular formula of 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole is C11H10ClN3O3.
What is the molecular weight of 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole?
The molecular weight of 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole is 267.04 g/mol.
Where can I buy 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole?
You can request a quote for 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3-Carbamoyl-1-(3-chloro-4-hydroxyphenyl)-5-methoxypyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.