ChemDiv1_022306
TL;DR: ChemDiv1_022306 (CAS 307329-38-0) is a chemical compound with molecular formula C30H35NO8S3 and molecular weight 633.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetraethyl 5',5',6',9'-tetramethylspiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Also Known As: ChemDiv1_022306, BAS 00225092, tetraethyl 5',5',6',9'-tetramethylspiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate, 2',3',4,5-TETRAETHYL 5',5',6',9'-TETRAMETHYL-5',6'-DIHYDROSPIRO[1,3-DITHIOLE-2,1'-THIOPYRANO[2,3-C]QUINOLINE]-2',3',4,5-TETRACARBOXYLATE, tetraethyl 5',5',6',9'-tetramethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
| Molecular Formula | C30H35NO8S3 |
|---|---|
| Molecular Weight | 633.15 g/mol |
| LogP | 5.57572 |
| Topological Polar Surface Area | 108.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 633.15247 |
| Heavy Atoms | 42 |
| Complexity | 1411.5986 |
Chemical Identifiers
| CAS Number | 307329-38-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C(C13SC(=C(S3)C(=O)OCC)C(=O)OCC)C4=C(C=CC(=C4)C)N(C2(C)C)C)C(=O)OCC |
Product Overview
ChemDiv1_022306 (CAS 307329-38-0), with molecular formula C30H35NO8S3 and molecular weight 633.15 g/mol. IUPAC: tetraethyl 5',5',6',9'-tetramethylspiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate.
Chemical Property Profile of ChemDiv1_022306
Property Insights of ChemDiv1_022306
The XLogP value of 5.57572 indicates that ChemDiv1_022306 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.44 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022306. Following Lipinski's Rule of Five, ChemDiv1_022306 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022306?
The CAS number of ChemDiv1_022306 is 307329-38-0.
What is the molecular formula of ChemDiv1_022306?
The molecular formula of ChemDiv1_022306 is C30H35NO8S3.
What is the molecular weight of ChemDiv1_022306?
The molecular weight of ChemDiv1_022306 is 633.15 g/mol.
Where can I buy ChemDiv1_022306?
You can request a quote for ChemDiv1_022306 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022306?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022306 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.