4-[4-(dimethylamino)phenyl]-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Chemical Structure Depiction of
4-[4-(dimethylamino)phenyl]-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
4-[4-(dimethylamino)phenyl]-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Compound characteristics
| Compound ID: | 4643-0179 |
| Compound Name: | 4-[4-(dimethylamino)phenyl]-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one |
| Molecular Weight: | 440.57 |
| Molecular Formula: | C26 H24 N4 O S |
| Smiles: | CN(C)c1ccc(cc1)C1c2c(c3ccccc3)nn(c3ccccc3)c2NC(CS1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0158 |
| logD: | 5.0123 |
| logSw: | -4.5894 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.149 |
| InChI Key: | JAHWLYSLJAKCHE-RUZDIDTESA-N |