7-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]-10-ethyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
7-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]-10-ethyldibenzo[b,f][1,4]thiazepin-11(10H)-one
7-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]-10-ethyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0205 |
| Compound Name: | 7-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]-10-ethyldibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C25 H21 N3 O2 S |
| Smiles: | CCN1C(c2ccccc2Sc2cc(ccc12)c1nc(c2cc(C)cc(C)c2)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7542 |
| logD: | 6.7542 |
| logSw: | -5.6191 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.803 |
| InChI Key: | IGNXIJWMEFCUAS-UHFFFAOYSA-N |