2-[2-(7-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]-1H-isoindole-1,3(2H)-dione

Base Information

• Chemical Name: 2-[2-(7-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]-1H-isoindole-1,3(2H)-dione
• CAS No.: 331840-78-9
• Molecular Formula: C23H18N2O4S3
• Molecular Weight: 482.6
• NSC Number: 727706
• DSSTox Substance ID: DTXSID20365067
• Wikidata: Q82149443
• Mol file: 331840-78-9.mol

Synonyms:331840-78-9;2-[2-(7-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]-1H-isoindole-1,3(2H)-dione;2-[2-(7-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]isoindole-1,3-dione;CDS1_003079;CBMicro_026663;ChemDiv1_022855;Oprea1_156866;Oprea1_810642;DivK1c_004119;HMS651O19;DTXSID20365067;VGWPSXWYAHWRBL-UHFFFAOYSA-N;NSC727706;STK870975;AKOS000618362;NSC-727706;BIM-0026726.P001;AK-968/11565186;SR-01000449825;SR-01000449825-1;2-[2-(7-Methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-2,3-dithia-5-aza-cyclopenta[a]

Chemical Property of 2-[2-(7-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]-1H-isoindole-1,3(2H)-dione

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 482.04287058
• Heavy Atom Count: 32
• Complexity: 893

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1(C2=C(C3=C(N1C(=O)CN4C(=O)C5=CC=CC=C5C4=O)C=C(C=C3)OC)C(=S)SS2)C