AC1LW8E3
ethyl (2Z)-5-phenyl-2-(2,2,7-trimethyl-3-sulfanylidene-1H-quinolin-4-ylidene)-1,3-dithiole-4-carboxylate
Also Known As: BAS 00458916|AG-690/11096063|(Z)-ethyl 5-phenyl-2-(2,2,7-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4-carboxylate|ethyl (2Z)-5-phenyl-2-(2,2,7-trimethyl-3-sulfanylidene-1H-quinolin-4-ylidene)-1,3-dithiole-4-carboxylate|ethyl (2Z)-5-phenyl-2-(2,2,7-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4-carboxylate|ethyl 5-phenyl-2-(2,2,7-trimethyl-3-thioxo(4-1,2-dihydroquinolylidene))-1,3-di thiolene-4-carboxylate|ethyl 5-phenyl-2-(2,2,7-trimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4-carboxylate
| Molecular Formula | C24H23NO2S3 |
|---|---|
| Molecular Weight | 453.08908 g/mol |
| LogP | 6.64952 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 453.08908 |
| Monoisotopic Mass | 453.08908 |
| Heavy Atoms | 30 |
| Complexity | 1100.6891 |
Chemical Identifiers
| CAS Number | 307337-41-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(S/C(=C/2\C3=C(C=C(C=C3)C)NC(C2=S)(C)C)/S1)C4=CC=CC=C4 |
Product Overview
AC1LW8E3 (CAS 307337-41-3), with molecular formula C24H23NO2S3 and molecular weight 453.08908 g/mol. IUPAC: ethyl (2Z)-5-phenyl-2-(2,2,7-trimethyl-3-sulfanylidene-1H-quinolin-4-ylidene)-1,3-dithiole-4-carboxylate.