(2,11-dimethyldibenzo[b,f][1,4]thiazepin-8-yl)[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(2,11-dimethyldibenzo[b,f][1,4]thiazepin-8-yl)[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone
(2,11-dimethyldibenzo[b,f][1,4]thiazepin-8-yl)[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | C304-1173 |
| Compound Name: | (2,11-dimethyldibenzo[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: | CC1CN(CCN1c1cccc(C)c1)C(c1ccc2c(c1)N=C(C)c1cc(C)ccc1S2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0669 |
| logD: | 6.0661 |
| logSw: | -5.3491 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.6273 |
| InChI Key: | MKWWULTVANDYBP-FQEVSTJZSA-N |