ChemDiv1_023780
TL;DR: ChemDiv1_023780 (CAS 374912-32-0) is a chemical compound with molecular formula C20H25NOS3 and molecular weight 391.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-1-(4,4,7,8-tetramethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one
Also Known As: ChemDiv1_023780, 2-ethyl-1-(4,4,7,8-tetramethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one, 2-ethyl-1-(4,4,7,8-tetramethyl-1-thioxo(4,5-dihydro-1,2-dithioleno[5,4-c]quino lin-5-yl))butan-1-one, 2-ethyl-1-(4,4,7,8-tetramethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one, 2-ethyl-1-(4,4,7,8-tetramethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)butan-1-one
| Molecular Formula | C20H25NOS3 |
|---|---|
| Molecular Weight | 391.11 g/mol |
| LogP | 6.84083 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.10983 |
| Heavy Atoms | 25 |
| Complexity | 886.8316 |
Chemical Identifiers
| CAS Number | 374912-32-0 |
|---|---|
| SMILES | CCC(CC)C(=O)N1C2=C(C=C(C(=C2)C)C)C3=C(C1(C)C)SSC3=S |
Product Overview
ChemDiv1_023780 (CAS 374912-32-0), with molecular formula C20H25NOS3 and molecular weight 391.11 g/mol. IUPAC: 2-ethyl-1-(4,4,7,8-tetramethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one.
Chemical Property Profile of ChemDiv1_023780
Property Insights of ChemDiv1_023780
The XLogP value of 6.84083 indicates that ChemDiv1_023780 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_023780 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_023780 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_023780?
The CAS number of ChemDiv1_023780 is 374912-32-0.
What is the molecular formula of ChemDiv1_023780?
The molecular formula of ChemDiv1_023780 is C20H25NOS3.
What is the molecular weight of ChemDiv1_023780?
The molecular weight of ChemDiv1_023780 is 391.11 g/mol.
Where can I buy ChemDiv1_023780?
You can request a quote for ChemDiv1_023780 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023780?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023780 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.