(11-propyldibenzo[b,f][1,4]thiazepin-8-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(11-propyldibenzo[b,f][1,4]thiazepin-8-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
(11-propyldibenzo[b,f][1,4]thiazepin-8-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | C304-4798 |
| Compound Name: | (11-propyldibenzo[b,f][1,4]thiazepin-8-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone |
| Molecular Weight: | 509.59 |
| Molecular Formula: | C28 H26 F3 N3 O S |
| Smiles: | CCCC1c2ccccc2Sc2ccc(cc2N=1)C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.308 |
| logD: | 6.3071 |
| logSw: | -5.6481 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.1393 |
| InChI Key: | ITGUSMCVVZCORR-UHFFFAOYSA-N |