12-[4-(methylsulfanyl)phenyl]-3,4,5,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1(2H)-one
Chemical Structure Depiction of
12-[4-(methylsulfanyl)phenyl]-3,4,5,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1(2H)-one
12-[4-(methylsulfanyl)phenyl]-3,4,5,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1(2H)-one
Compound characteristics
| Compound ID: | K832-3199 |
| Compound Name: | 12-[4-(methylsulfanyl)phenyl]-3,4,5,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1(2H)-one |
| Molecular Weight: | 361.46 |
| Molecular Formula: | C21 H19 N3 O S |
| Smiles: | CSc1ccc(cc1)C1C2=C(CCCC2=O)Nc2nc3ccccc3n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7059 |
| logD: | 4.699 |
| logSw: | -4.4199 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.601 |
| InChI Key: | ALKKTDYAZBOLDO-FQEVSTJZSA-N |