BAS 00315527
TL;DR: BAS 00315527 (CAS 305383-60-2) is a chemical compound with molecular formula C34H33NO11S3 and molecular weight 727.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetramethyl 7'-ethoxy-5',5'-dimethyl-6'-(2-phenoxyacetyl)spiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Also Known As: BAS 00315527, tetramethyl 8-ethoxy-5,5-dimethyl-6-(phenoxyacetyl)-5,6-dihydrospiro(1H-thiopyrano[2,3-c]quinoline-1,2'-[1,3]-dithiole)-2,3,4',5'-tetracarboxylate, tetramethyl 7'-ethoxy-5',5'-dimethyl-6'-(phenoxyacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate, tetramethyl 7'-ethoxy-5',5'-dimethyl-6'-(2-phenoxyacetyl)spiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate, tetramethyl 7'-ethoxy-5',5'-dimethyl-6'-(2-phenoxyacetyl)-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
| Molecular Formula | C34H33NO11S3 |
|---|---|
| Molecular Weight | 727.12 g/mol |
| LogP | 5.0814 |
| Topological Polar Surface Area | 143.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 727.1216 |
| Heavy Atoms | 49 |
| Complexity | 1803.0585 |
Chemical Identifiers
| CAS Number | 305383-60-2 |
|---|---|
| SMILES | CCOC1=CC=CC2=C1N(C(C3=C2C4(C(=C(S3)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)(C)C)C(=O)COC5=CC=CC=C5 |
Product Overview
BAS 00315527 (CAS 305383-60-2), with molecular formula C34H33NO11S3 and molecular weight 727.12 g/mol. IUPAC: tetramethyl 7'-ethoxy-5',5'-dimethyl-6'-(2-phenoxyacetyl)spiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate.
Chemical Property Profile of BAS 00315527
Property Insights of BAS 00315527
The XLogP value of 5.0814 indicates that BAS 00315527 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 143.97 Ų indicates high polarity, suggesting BAS 00315527 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00315527 has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00315527?
The CAS number of BAS 00315527 is 305383-60-2.
What is the molecular formula of BAS 00315527?
The molecular formula of BAS 00315527 is C34H33NO11S3.
What is the molecular weight of BAS 00315527?
The molecular weight of BAS 00315527 is 727.12 g/mol.
Where can I buy BAS 00315527?
You can request a quote for BAS 00315527 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00315527?
Yes, KEHONG BIO provides custom synthesis services for BAS 00315527 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.