AS-871/43351587
TL;DR: AS-871/43351587 (CAS 879430-48-5) is a chemical compound with molecular formula C22H24N4O4S and molecular weight 440.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxyphenyl)-N-[3-(2-methoxyethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1H-pyrazole-5-carboxamide
Also Known As: AS-871/43351587, 3-(2-Hydroxyphenyl)-N-[3-(2-methoxyethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1H-pyrazole-5-carboxamide, (5Z)-N-[3-(2-methoxyethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide, 3-(2-hydroxyphenyl)-N-(3-{[(2-methoxyethyl)amino]carbonyl}-4,5,6,7-tetrahydro-1-benzothien-2-yl)-1H-pyrazole-5-carboxamide, 3-(2-hydroxyphenyl)-N-(3-((2-methoxyethyl)carbamoyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-1H-pyrazole-5-carboxamide
| Molecular Formula | C22H24N4O4S |
|---|---|
| Molecular Weight | 440.15 g/mol |
| LogP | 3.3511 |
| Topological Polar Surface Area | 116.34 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 440.15182 |
| Heavy Atoms | 31 |
| Complexity | 1104.8785 |
Chemical Identifiers
| CAS Number | 879430-48-5 |
|---|---|
| SMILES | COCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=NN3)C4=CC=CC=C4O |
Product Overview
AS-871/43351587 (CAS 879430-48-5), with molecular formula C22H24N4O4S and molecular weight 440.15 g/mol. IUPAC: 3-(2-hydroxyphenyl)-N-[3-(2-methoxyethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1H-pyrazole-5-carboxamide.
Chemical Property Profile of AS-871/43351587
Property Insights of AS-871/43351587
The XLogP value of 3.3511 indicates that AS-871/43351587 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/43351587. Following Lipinski's Rule of Five, AS-871/43351587 has 4 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-871/43351587?
The CAS number of AS-871/43351587 is 879430-48-5.
What is the molecular formula of AS-871/43351587?
The molecular formula of AS-871/43351587 is C22H24N4O4S.
What is the molecular weight of AS-871/43351587?
The molecular weight of AS-871/43351587 is 440.15 g/mol.
Where can I buy AS-871/43351587?
You can request a quote for AS-871/43351587 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/43351587?
Yes, KEHONG BIO provides custom synthesis services for AS-871/43351587 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.