ChemDiv1_022627
TL;DR: ChemDiv1_022627 (CAS 296272-26-9) is a chemical compound with molecular formula C20H17NOS3 and molecular weight 383.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-phenylethanone
Also Known As: ChemDiv1_022627, DivK1c_003891, CDS1_002851, BAS 00351145, UPCMLD0ENAT0400-0600:001
| Molecular Formula | C20H17NOS3 |
|---|---|
| Molecular Weight | 383.05 g/mol |
| LogP | 6.03049 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 383.04724 |
| Heavy Atoms | 25 |
| Complexity | 1001.03564 |
Chemical Identifiers
| CAS Number | 296272-26-9 |
|---|---|
| SMILES | CC1(C2=C(C3=CC=CC=C3N1C(=O)CC4=CC=CC=C4)C(=S)SS2)C |
Product Overview
ChemDiv1_022627 (CAS 296272-26-9), with molecular formula C20H17NOS3 and molecular weight 383.05 g/mol. IUPAC: 1-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-phenylethanone.
Chemical Property Profile of ChemDiv1_022627
Property Insights of ChemDiv1_022627
The XLogP value of 6.03049 indicates that ChemDiv1_022627 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, ChemDiv1_022627 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_022627 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022627?
The CAS number of ChemDiv1_022627 is 296272-26-9.
What is the molecular formula of ChemDiv1_022627?
The molecular formula of ChemDiv1_022627 is C20H17NOS3.
What is the molecular weight of ChemDiv1_022627?
The molecular weight of ChemDiv1_022627 is 383.05 g/mol.
Where can I buy ChemDiv1_022627?
You can request a quote for ChemDiv1_022627 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022627?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022627 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.