ChemDiv1_022633
TL;DR: ChemDiv1_022633 (CAS 328070-70-8) is a chemical compound with molecular formula C23H25NO5S3 and molecular weight 491.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(2,2,6,7-tetramethyl-1-propanoyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate
Also Known As: ChemDiv1_022633, DivK1c_003897, CDS1_002857, BAS 00584668, dimethyl 2-(2,2,6,7-tetramethyl-1-propanoyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate
| Molecular Formula | C23H25NO5S3 |
|---|---|
| Molecular Weight | 491.09 g/mol |
| LogP | 4.91474 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 491.08948 |
| Heavy Atoms | 32 |
| Complexity | 1086.8738 |
Chemical Identifiers
| CAS Number | 328070-70-8 |
|---|---|
| SMILES | CCC(=O)N1C2=C(C=C(C(=C2)C)C)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C |
Product Overview
ChemDiv1_022633 (CAS 328070-70-8), with molecular formula C23H25NO5S3 and molecular weight 491.09 g/mol. IUPAC: dimethyl 2-(2,2,6,7-tetramethyl-1-propanoyl-3-sulfanylidenequinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate.
Chemical Property Profile of ChemDiv1_022633
Property Insights of ChemDiv1_022633
The XLogP value of 4.91474 indicates that ChemDiv1_022633 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022633. Following Lipinski's Rule of Five, ChemDiv1_022633 has 0 hydrogen bond donor(s) and 8 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_022633?
The CAS number of ChemDiv1_022633 is 328070-70-8.
What is the molecular formula of ChemDiv1_022633?
The molecular formula of ChemDiv1_022633 is C23H25NO5S3.
What is the molecular weight of ChemDiv1_022633?
The molecular weight of ChemDiv1_022633 is 491.09 g/mol.
Where can I buy ChemDiv1_022633?
You can request a quote for ChemDiv1_022633 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022633?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022633 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.