AB00684169-01
TL;DR: AB00684169-01 (CAS 330190-23-3) is a chemical compound with molecular formula C22H19N3O3S2 and molecular weight 437.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[(4-methylphenyl)sulfonylamino]benzamide
Also Known As: AB00684169-01, F0325-0174, N-{3-cyano-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-2-(4-methylbenzenesulfonamido)benzamide, N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[(4-methylphenyl)sulfonylamino]benzamide, N-{4-cyano-2-thiabicyclo[3.3.0]octa-1(5),3-dien-3-yl}o-(tosylamino)benzamide
| Molecular Formula | C22H19N3O3S2 |
|---|---|
| Molecular Weight | 437.09 g/mol |
| LogP | 4.47 |
| Topological Polar Surface Area | 99.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.0868 |
| Heavy Atoms | 30 |
| Complexity | 1269.9469 |
Chemical Identifiers
| CAS Number | 330190-23-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=C(C4=C(S3)CCC4)C#N |
Product Overview
AB00684169-01 (CAS 330190-23-3), with molecular formula C22H19N3O3S2 and molecular weight 437.09 g/mol. IUPAC: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[(4-methylphenyl)sulfonylamino]benzamide.
Chemical Property Profile of AB00684169-01
Property Insights of AB00684169-01
The XLogP value of 4.47 indicates that AB00684169-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.06 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00684169-01. Following Lipinski's Rule of Five, AB00684169-01 has 2 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 AB00684169-01?
The CAS number of AB00684169-01 is 330190-23-3.
What is the molecular formula of AB00684169-01?
The molecular formula of AB00684169-01 is C22H19N3O3S2.
What is the molecular weight of AB00684169-01?
The molecular weight of AB00684169-01 is 437.09 g/mol.
Where can I buy AB00684169-01?
You can request a quote for AB00684169-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684169-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684169-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.