1-(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)-2-[(2-methylquinazolin-4-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)-2-[(2-methylquinazolin-4-yl)sulfanyl]ethan-1-one
1-(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)-2-[(2-methylquinazolin-4-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 8018-9134 |
| Compound Name: | 1-(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)-2-[(2-methylquinazolin-4-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C24 H26 N4 O S |
| Smiles: | Cc1ccc2c(c1)C1CN(C)CCC1N2C(CSc1c2ccccc2nc(C)n1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2483 |
| logD: | 1.5117 |
| logSw: | -3.4827 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 35.694 |
| InChI Key: | WPRFCXGUCIRKHE-UHFFFAOYSA-N |