BAS 00315525
TL;DR: BAS 00315525 (CAS 307336-46-5) is a chemical compound with molecular formula C22H21NO3S3 and molecular weight 443.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-phenoxyethanone
Also Known As: BAS 00315525, 6-ethoxy-4,4-dimethyl-5-(phenoxyacetyl)-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione, 1-(6-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-phenoxyethanone, 1-(6-ethoxy-4,4-dimethyl-1-thioxo(4,5-dihydro-1,2-dithioleno[5,4-c]quinolin-5- yl))-2-phenoxyethan-1-one, 1-(6-Ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-2,3-dithia-5-aza-cyclopenta[a]naphthalen-5-yl)-2-phenoxy-ethanone
| Molecular Formula | C22H21NO3S3 |
|---|---|
| Molecular Weight | 443.07 g/mol |
| LogP | 6.26549 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.06836 |
| Heavy Atoms | 29 |
| Complexity | 1101.9904 |
Chemical Identifiers
| CAS Number | 307336-46-5 |
|---|---|
| SMILES | CCOC1=CC=CC2=C1N(C(C3=C2C(=S)SS3)(C)C)C(=O)COC4=CC=CC=C4 |
Product Overview
BAS 00315525 (CAS 307336-46-5), with molecular formula C22H21NO3S3 and molecular weight 443.07 g/mol. IUPAC: 1-(6-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-phenoxyethanone.
Chemical Property Profile of BAS 00315525
Property Insights of BAS 00315525
The XLogP value of 6.26549 indicates that BAS 00315525 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, BAS 00315525 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00315525 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00315525?
The CAS number of BAS 00315525 is 307336-46-5.
What is the molecular formula of BAS 00315525?
The molecular formula of BAS 00315525 is C22H21NO3S3.
What is the molecular weight of BAS 00315525?
The molecular weight of BAS 00315525 is 443.07 g/mol.
Where can I buy BAS 00315525?
You can request a quote for BAS 00315525 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00315525?
Yes, KEHONG BIO provides custom synthesis services for BAS 00315525 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.