ChemDiv1_023878
TL;DR: ChemDiv1_023878 (CAS 351498-71-0) is a chemical compound with molecular formula C24H20N2O3S3 and molecular weight 480.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-oxo-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)propan-2-yl]isoindole-1,3-dione
Also Known As: ChemDiv1_023878, BIM-0029190.P001, 2-[1-methyl-2-oxo-2-(4,4,8-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethyl]-1H-isoindole-1,3(2H)-dione, 2-[1-oxo-1-(4,4,8-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-2-yl]-1H-isoindole-1,3(2H)-dione, 2-(1-oxo-1-(4,4,8-trimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)propan-2-yl)isoindoline-1,3-dione
| Molecular Formula | C24H20N2O3S3 |
|---|---|
| Molecular Weight | 480.06 g/mol |
| LogP | 5.78091 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 480.0636 |
| Heavy Atoms | 32 |
| Complexity | 1350.1215 |
Chemical Identifiers
| CAS Number | 351498-71-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)C(=O)C(C)N4C(=O)C5=CC=CC=C5C4=O |
Product Overview
ChemDiv1_023878 (CAS 351498-71-0), with molecular formula C24H20N2O3S3 and molecular weight 480.06 g/mol. IUPAC: 2-[1-oxo-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)propan-2-yl]isoindole-1,3-dione.
Chemical Property Profile of ChemDiv1_023878
Property Insights of ChemDiv1_023878
The XLogP value of 5.78091 indicates that ChemDiv1_023878 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, ChemDiv1_023878 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_023878 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 ChemDiv1_023878?
The CAS number of ChemDiv1_023878 is 351498-71-0.
What is the molecular formula of ChemDiv1_023878?
The molecular formula of ChemDiv1_023878 is C24H20N2O3S3.
What is the molecular weight of ChemDiv1_023878?
The molecular weight of ChemDiv1_023878 is 480.06 g/mol.
Where can I buy ChemDiv1_023878?
You can request a quote for ChemDiv1_023878 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023878?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023878 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.