ChemDiv1_005346
TL;DR: ChemDiv1_005346 (CAS 430429-03-1) is a chemical compound with molecular formula C24H19N3O3S and molecular weight 429.11 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)-4-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)benzamide
Also Known As: ChemDiv1_005346, BAS 02081571, N-(3-Cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)-4-(1,3,3a,4,7,7a-hexahydro-1,3-dioxo-4,7-methano-2H-isoindol-2-yl)benzamide
| Molecular Formula | C24H19N3O3S |
|---|---|
| Molecular Weight | 429.11 g/mol |
| LogP | 3.67228 |
| Topological Polar Surface Area | 90.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 429.11472 |
| Heavy Atoms | 31 |
| Complexity | 1189.9296 |
Chemical Identifiers
| CAS Number | 430429-03-1 |
|---|---|
| SMILES | C1CC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)N4C(=O)C5C6CC(C5C4=O)C=C6 |
Product Overview
ChemDiv1_005346 (CAS 430429-03-1), with molecular formula C24H19N3O3S and molecular weight 429.11 g/mol. IUPAC: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)benzamide.
Chemical Property Profile of ChemDiv1_005346
Property Insights of ChemDiv1_005346
The XLogP value of 3.67228 indicates that ChemDiv1_005346 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.27 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005346. Following Lipinski's Rule of Five, ChemDiv1_005346 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 ChemDiv1_005346?
The CAS number of ChemDiv1_005346 is 430429-03-1.
What is the molecular formula of ChemDiv1_005346?
The molecular formula of ChemDiv1_005346 is C24H19N3O3S.
What is the molecular weight of ChemDiv1_005346?
The molecular weight of ChemDiv1_005346 is 429.11 g/mol.
Where can I buy ChemDiv1_005346?
You can request a quote for ChemDiv1_005346 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005346?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005346 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.