(11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone
(11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | C304-0340 |
| Compound Name: | (11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 455.62 |
| Molecular Formula: | C28 H29 N3 O S |
| Smiles: | CCC1c2ccccc2Sc2ccc(cc2N=1)C(N1CCN(C(C)C1)c1cccc(C)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8335 |
| logD: | 5.832 |
| logSw: | -5.4342 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.3576 |
| InChI Key: | QYUSEKSGPYUNMZ-FQEVSTJZSA-N |