11-(4-chlorophenyl)-11,11a-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Chemical Structure Depiction of
11-(4-chlorophenyl)-11,11a-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
11-(4-chlorophenyl)-11,11a-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Compound characteristics
| Compound ID: | 5750-3021 |
| Compound Name: | 11-(4-chlorophenyl)-11,11a-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one |
| Molecular Weight: | 375.87 |
| Molecular Formula: | C22 H14 Cl N O S |
| Smiles: | c1ccc2C(C3C(c4ccc(cc4)[Cl])Sc4ccccc4N=C3c2c1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4287 |
| logD: | 5.4147 |
| logSw: | -6.1824 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 20.9818 |
| InChI Key: | MIPUARQYLXBKLS-UHFFFAOYSA-N |