N-[(5-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[(5-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
N-[(5-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | C328-0115 |
| Compound Name: | N-[(5-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 506.96 |
| Molecular Formula: | C22 H23 Cl N4 O6 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1nnc(CNC(c2cc(c(c(c2)OC)OC)OC)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3164 |
| logD: | 3.3162 |
| logSw: | -3.7612 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.542 |
| InChI Key: | ZFSQITZFKIRSJY-UHFFFAOYSA-N |