10-(propan-2-yl)-7-[5-(pyrazin-2-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
10-(propan-2-yl)-7-[5-(pyrazin-2-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
10-(propan-2-yl)-7-[5-(pyrazin-2-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0831 |
| Compound Name: | 10-(propan-2-yl)-7-[5-(pyrazin-2-yl)-1,2,4-oxadiazol-3-yl]dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C22 H17 N5 O2 S |
| Smiles: | CC(C)N1C(c2ccccc2Sc2cc(ccc12)c1nc(c2cnccn2)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4339 |
| logD: | 4.4339 |
| logSw: | -4.3757 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.364 |
| InChI Key: | YTCANNACIUUZEI-UHFFFAOYSA-N |