4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide
TL;DR: 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide (CAS 492426-38-7) is a chemical compound with molecular formula C13H12ClN3O2 and molecular weight 277.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide
Also Known As: ChemDiv3_006135, CBKinase1_002808, CBKinase1_015208, IDI1_024045, 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide
| Molecular Formula | C13H12ClN3O2 |
|---|---|
| Molecular Weight | 277.06 g/mol |
| LogP | 1.6862 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.0618 |
| Heavy Atoms | 19 |
| Complexity | 607.60583 |
Chemical Identifiers
| CAS Number | 492426-38-7 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)NCC(=O)C2=CC=CC=C2)Cl |
Product Overview
4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide (CAS 492426-38-7), with molecular formula C13H12ClN3O2 and molecular weight 277.06 g/mol. IUPAC: 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide.
Chemical Property Profile of 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide
Property Insights of 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide
The XLogP value of 1.6862 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide has 1 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 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide?
The CAS number of 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide is 492426-38-7.
What is the molecular formula of 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide?
The molecular formula of 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide is C13H12ClN3O2.
What is the molecular weight of 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide?
The molecular weight of 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide is 277.06 g/mol.
Where can I buy 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide?
You can request a quote for 4-chloro-1-methyl-N-phenacylpyrazole-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-1-methyl-N-phenacylpyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-1-methyl-N-phenacylpyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.