BIM-0004057.P001
TL;DR: BIM-0004057.P001 (CAS 376373-24-9) is a chemical compound with molecular formula C20H18N2O2S3 and molecular weight 414.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-pyridin-3-ylmethanone
Also Known As: BIM-0004057.P001, (8-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-pyridin-3-ylmethanone, (8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(pyridin-3-yl)methanone, (8-ethoxy-4,4-dimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)(pyridin-3-yl)methanone, 8-ethoxy-4,4-dimethyl-5-(3-pyridinylcarbonyl)-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione
| Molecular Formula | C20H18N2O2S3 |
|---|---|
| Molecular Weight | 414.05 g/mol |
| LogP | 5.89529 |
| Topological Polar Surface Area | 42.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.05304 |
| Heavy Atoms | 27 |
| Complexity | 1070.3309 |
Chemical Identifiers
| CAS Number | 376373-24-9 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)C(=O)C4=CN=CC=C4 |
Product Overview
BIM-0004057.P001 (CAS 376373-24-9), with molecular formula C20H18N2O2S3 and molecular weight 414.05 g/mol. IUPAC: (8-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-pyridin-3-ylmethanone.
Chemical Property Profile of BIM-0004057.P001
Property Insights of BIM-0004057.P001
The XLogP value of 5.89529 indicates that BIM-0004057.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.43 Ų, BIM-0004057.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0004057.P001 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 BIM-0004057.P001?
The CAS number of BIM-0004057.P001 is 376373-24-9.
What is the molecular formula of BIM-0004057.P001?
The molecular formula of BIM-0004057.P001 is C20H18N2O2S3.
What is the molecular weight of BIM-0004057.P001?
The molecular weight of BIM-0004057.P001 is 414.05 g/mol.
Where can I buy BIM-0004057.P001?
You can request a quote for BIM-0004057.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0004057.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0004057.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.