10-propyl-7-{5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
10-propyl-7-{5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}dibenzo[b,f][1,4]thiazepin-11(10H)-one
10-propyl-7-{5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0447 |
| Compound Name: | 10-propyl-7-{5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 481.5 |
| Molecular Formula: | C25 H18 F3 N3 O2 S |
| Smiles: | CCCN1C(c2ccccc2Sc2cc(ccc12)c1nc(c2ccc(cc2)C(F)(F)F)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5096 |
| logD: | 7.5096 |
| logSw: | -5.6888 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.056 |
| InChI Key: | UTHNGHZNWJOUDK-UHFFFAOYSA-N |