AB00865847-06
TL;DR: AB00865847-06 (CAS 893948-27-1) is a chemical compound with molecular formula C21H17N3O4S and molecular weight 407.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-1-benzofuran-2-carboxamide
Also Known As: AB00865847-06, F1879-0371, N-(5,5-dioxido-2-(p-tolyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzofuran-2-carboxamide, N-[2-(4-methylphenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]-1-benzofuran-2-carboxamide, N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-1-benzofuran-2-carboxamide
| Molecular Formula | C21H17N3O4S |
|---|---|
| Molecular Weight | 407.09 g/mol |
| LogP | 3.60762 |
| Topological Polar Surface Area | 94.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 407.09396 |
| Heavy Atoms | 29 |
| Complexity | 1331.9492 |
Chemical Identifiers
| CAS Number | 893948-27-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=C3CS(=O)(=O)CC3=N2)NC(=O)C4=CC5=CC=CC=C5O4 |
Product Overview
AB00865847-06 (CAS 893948-27-1), with molecular formula C21H17N3O4S and molecular weight 407.09 g/mol. IUPAC: N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of AB00865847-06
Property Insights of AB00865847-06
The XLogP value of 3.60762 indicates that AB00865847-06 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.2 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00865847-06. Following Lipinski's Rule of Five, AB00865847-06 has 1 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 AB00865847-06?
The CAS number of AB00865847-06 is 893948-27-1.
What is the molecular formula of AB00865847-06?
The molecular formula of AB00865847-06 is C21H17N3O4S.
What is the molecular weight of AB00865847-06?
The molecular weight of AB00865847-06 is 407.09 g/mol.
Where can I buy AB00865847-06?
You can request a quote for AB00865847-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00865847-06?
Yes, KEHONG BIO provides custom synthesis services for AB00865847-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.