ChemDiv1_022573
TL;DR: ChemDiv1_022573 (CAS 303966-41-8) is a chemical compound with molecular formula C20H16FNO2S3 and molecular weight 417.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-fluorophenyl)-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)methanone
Also Known As: ChemDiv1_022573, DivK1c_003837, CDS1_002797, BAS 00364137, (2-fluorophenyl)(8-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone
| Molecular Formula | C20H16FNO2S3 |
|---|---|
| Molecular Weight | 417.03 g/mol |
| LogP | 6.24929 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 417.0327 |
| Heavy Atoms | 27 |
| Complexity | 1116.4098 |
Chemical Identifiers
| CAS Number | 303966-41-8 |
|---|---|
| SMILES | CC1(C2=C(C3=C(N1C(=O)C4=CC=CC=C4F)C=CC(=C3)OC)C(=S)SS2)C |
Product Overview
ChemDiv1_022573 (CAS 303966-41-8), with molecular formula C20H16FNO2S3 and molecular weight 417.03 g/mol. IUPAC: (2-fluorophenyl)-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)methanone.
Chemical Property Profile of ChemDiv1_022573
Property Insights of ChemDiv1_022573
The XLogP value of 6.24929 indicates that ChemDiv1_022573 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, ChemDiv1_022573 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_022573 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022573?
The CAS number of ChemDiv1_022573 is 303966-41-8.
What is the molecular formula of ChemDiv1_022573?
The molecular formula of ChemDiv1_022573 is C20H16FNO2S3.
What is the molecular weight of ChemDiv1_022573?
The molecular weight of ChemDiv1_022573 is 417.03 g/mol.
Where can I buy ChemDiv1_022573?
You can request a quote for ChemDiv1_022573 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022573?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022573 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.