7-[5-(3-chloro-4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-10-propyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
7-[5-(3-chloro-4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-10-propyldibenzo[b,f][1,4]thiazepin-11(10H)-one
7-[5-(3-chloro-4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-10-propyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0444 |
| Compound Name: | 7-[5-(3-chloro-4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-10-propyldibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 465.93 |
| Molecular Formula: | C24 H17 Cl F N3 O2 S |
| Smiles: | CCCN1C(c2ccccc2Sc2cc(ccc12)c1nc(c2ccc(c(c2)[Cl])F)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0965 |
| logD: | 7.0965 |
| logSw: | -6.2401 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.056 |
| InChI Key: | XMHWTYQGSICSBM-UHFFFAOYSA-N |