(11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
(11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | C304-0330 |
| Compound Name: | (11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 472.57 |
| Molecular Formula: | C26 H24 N4 O3 S |
| Smiles: | CCC1c2ccccc2Sc2ccc(cc2N=1)C(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0008 |
| logD: | 4.9993 |
| logSw: | -4.5706 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.521 |
| InChI Key: | DYNNHQCODJLRAA-UHFFFAOYSA-N |