ChemDiv1_022585
TL;DR: ChemDiv1_022585 (CAS 258267-24-2) is a chemical compound with molecular formula C25H25NO9S3 and molecular weight 579.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetramethyl 9'-methoxy-5',5'-dimethylspiro[1,3-dithiole-2,1'-6H-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Also Known As: ChemDiv1_022585, DivK1c_003849, CDS1_002809, BAS 00126906, methyl 14-methoxy-10,10-dimethyl-4,5,8-tris(methoxycarbonyl)spiro[1,3-dithiole ne-2,1'-5,6-dihydrothiino[2,3-c]quinoline]-7-carboxylate
| Molecular Formula | C25H25NO9S3 |
|---|---|
| Molecular Weight | 579.07 g/mol |
| LogP | 3.6912 |
| Topological Polar Surface Area | 126.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 5 |
| Exact Mass | 579.06915 |
| Heavy Atoms | 38 |
| Complexity | 1331.5212 |
Chemical Identifiers
| CAS Number | 258267-24-2 |
|---|---|
| SMILES | CC1(C2=C(C3=C(N1)C=CC(=C3)OC)C4(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)C |
Product Overview
ChemDiv1_022585 (CAS 258267-24-2), with molecular formula C25H25NO9S3 and molecular weight 579.07 g/mol. IUPAC: tetramethyl 9'-methoxy-5',5'-dimethylspiro[1,3-dithiole-2,1'-6H-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate.
Chemical Property Profile of ChemDiv1_022585
Property Insights of ChemDiv1_022585
The XLogP value of 3.6912 indicates that ChemDiv1_022585 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.46 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022585. Following Lipinski's Rule of Five, ChemDiv1_022585 has 1 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022585?
The CAS number of ChemDiv1_022585 is 258267-24-2.
What is the molecular formula of ChemDiv1_022585?
The molecular formula of ChemDiv1_022585 is C25H25NO9S3.
What is the molecular weight of ChemDiv1_022585?
The molecular weight of ChemDiv1_022585 is 579.07 g/mol.
Where can I buy ChemDiv1_022585?
You can request a quote for ChemDiv1_022585 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022585?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022585 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.