(11-ethyl-2-methyldibenzo[b,f][1,4]thiazepin-8-yl)(4-phenylpiperazin-1-yl)methanone
Chemical Structure Depiction of
(11-ethyl-2-methyldibenzo[b,f][1,4]thiazepin-8-yl)(4-phenylpiperazin-1-yl)methanone
(11-ethyl-2-methyldibenzo[b,f][1,4]thiazepin-8-yl)(4-phenylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | C304-3781 |
| Compound Name: | (11-ethyl-2-methyldibenzo[b,f][1,4]thiazepin-8-yl)(4-phenylpiperazin-1-yl)methanone |
| Molecular Weight: | 441.59 |
| Molecular Formula: | C27 H27 N3 O S |
| Smiles: | CCC1c2cc(C)ccc2Sc2ccc(cc2N=1)C(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.538 |
| logD: | 5.5362 |
| logSw: | -5.3859 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.1393 |
| InChI Key: | ZGKWQCHTTRWSGE-UHFFFAOYSA-N |