ChemDiv1_022563
TL;DR: ChemDiv1_022563 (CAS 332144-10-2) is a chemical compound with molecular formula C23H23NO6S3 and molecular weight 505.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[1-(cyclopropanecarbonyl)-6-methoxy-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate
Also Known As: ChemDiv1_022563, DivK1c_003827, CDS1_002787, BAS 01173673, AJ-292/13093034
| Molecular Formula | C23H23NO6S3 |
|---|---|
| Molecular Weight | 505.07 g/mol |
| LogP | 4.3065 |
| Topological Polar Surface Area | 82.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 505.06876 |
| Heavy Atoms | 33 |
| Complexity | 1118.8508 |
Chemical Identifiers
| CAS Number | 332144-10-2 |
|---|---|
| SMILES | CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=C(N1C(=O)C4CC4)C=CC(=C3)OC)C |
Product Overview
ChemDiv1_022563 (CAS 332144-10-2), with molecular formula C23H23NO6S3 and molecular weight 505.07 g/mol. IUPAC: dimethyl 2-[1-(cyclopropanecarbonyl)-6-methoxy-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate.
Chemical Property Profile of ChemDiv1_022563
Property Insights of ChemDiv1_022563
The XLogP value of 4.3065 indicates that ChemDiv1_022563 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.14 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022563. Following Lipinski's Rule of Five, ChemDiv1_022563 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022563?
The CAS number of ChemDiv1_022563 is 332144-10-2.
What is the molecular formula of ChemDiv1_022563?
The molecular formula of ChemDiv1_022563 is C23H23NO6S3.
What is the molecular weight of ChemDiv1_022563?
The molecular weight of ChemDiv1_022563 is 505.07 g/mol.
Where can I buy ChemDiv1_022563?
You can request a quote for ChemDiv1_022563 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022563?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022563 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.