ChemDiv1_023660
TL;DR: ChemDiv1_023660 (CAS 328069-01-8) is a chemical compound with molecular formula C17H13NOS4 and molecular weight 374.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-thiophen-2-ylmethanone
Also Known As: ChemDiv1_023660, BAS 00861921, 4,4-dimethyl-5-(2-thienylcarbonyl)-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione, (4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-thiophen-2-ylmethanone, (4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(thiophen-2-yl)methanone
| Molecular Formula | C17H13NOS4 |
|---|---|
| Molecular Weight | 374.99 g/mol |
| LogP | 6.16309 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 374.988 |
| Heavy Atoms | 23 |
| Complexity | 949.1411 |
Chemical Identifiers
| CAS Number | 328069-01-8 |
|---|---|
| SMILES | CC1(C2=C(C3=CC=CC=C3N1C(=O)C4=CC=CS4)C(=S)SS2)C |
Product Overview
ChemDiv1_023660 (CAS 328069-01-8), with molecular formula C17H13NOS4 and molecular weight 374.99 g/mol. IUPAC: (4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-thiophen-2-ylmethanone.
Chemical Property Profile of ChemDiv1_023660
Property Insights of ChemDiv1_023660
The XLogP value of 6.16309 indicates that ChemDiv1_023660 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_023660 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_023660 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_023660?
The CAS number of ChemDiv1_023660 is 328069-01-8.
What is the molecular formula of ChemDiv1_023660?
The molecular formula of ChemDiv1_023660 is C17H13NOS4.
What is the molecular weight of ChemDiv1_023660?
The molecular weight of ChemDiv1_023660 is 374.99 g/mol.
Where can I buy ChemDiv1_023660?
You can request a quote for ChemDiv1_023660 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023660?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023660 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.