N-[(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
N-[(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | C328-0113 |
| Compound Name: | N-[(5-{[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 522.96 |
| Molecular Formula: | C22 H23 Cl N4 O7 S |
| Smiles: | COc1ccc(cc1NC(CSc1nnc(CNC(c2cc(c(c(c2)OC)OC)OC)=O)o1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1791 |
| logD: | 2.1754 |
| logSw: | -3.3297 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.475 |
| InChI Key: | WMDQCSTWMISLFY-UHFFFAOYSA-N |