AS-871/43354764
TL;DR: AS-871/43354764 (CAS 879452-08-1) is a chemical compound with molecular formula C21H22N4O5S and molecular weight 442.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxy-5-methylphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)-1H-pyrazole-5-carboxamide
Also Known As: AS-871/43354764, 5-(2-hydroxy-5-methylphenyl)-N-[4-(morpholin-4-ylsulfonyl)phenyl]-1H-pyrazole-3-carboxamide, 3-(2-hydroxy-5-methylphenyl)-N-(4-(morpholinosulfonyl)phenyl)-1H-pyrazole-5-carboxamide, 3-(2-hydroxy-5-methylphenyl)-N-[4-(4-morpholinylsulfonyl)phenyl]-1H-pyrazole-5-carboxamide, (5Z)-5-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-(4-morpholin-4-ylsulfonylphenyl)-1,2-dihydropyrazole-3-carboxamide
| Molecular Formula | C21H22N4O5S |
|---|---|
| Molecular Weight | 442.13 g/mol |
| LogP | 2.36392 |
| Topological Polar Surface Area | 124.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.1311 |
| Heavy Atoms | 31 |
| Complexity | 1198.763 |
Chemical Identifiers
| CAS Number | 879452-08-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)O)C2=NNC(=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4 |
Product Overview
AS-871/43354764 (CAS 879452-08-1), with molecular formula C21H22N4O5S and molecular weight 442.13 g/mol. IUPAC: 3-(2-hydroxy-5-methylphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)-1H-pyrazole-5-carboxamide.
Chemical Property Profile of AS-871/43354764
Property Insights of AS-871/43354764
The XLogP value of 2.36392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS-871/43354764. The TPSA of 124.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/43354764. Following Lipinski's Rule of Five, AS-871/43354764 has 3 hydrogen bond donor(s) and 6 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 AS-871/43354764?
The CAS number of AS-871/43354764 is 879452-08-1.
What is the molecular formula of AS-871/43354764?
The molecular formula of AS-871/43354764 is C21H22N4O5S.
What is the molecular weight of AS-871/43354764?
The molecular weight of AS-871/43354764 is 442.13 g/mol.
Where can I buy AS-871/43354764?
You can request a quote for AS-871/43354764 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/43354764?
Yes, KEHONG BIO provides custom synthesis services for AS-871/43354764 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.