N-[(5-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[(5-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4-dimethoxybenzamide
N-[(5-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | C328-0475 |
| Compound Name: | N-[(5-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4-dimethoxybenzamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C22 H24 N4 O5 S |
| Smiles: | Cc1cc(C)cc(c1)NC(CSc1nnc(CNC(c2ccc(c(c2)OC)OC)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4626 |
| logD: | 2.4626 |
| logSw: | -2.8645 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.825 |
| InChI Key: | YUXYBFFXUKLELQ-UHFFFAOYSA-N |