N-[(5-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[(5-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-4-methoxybenzamide
N-[(5-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | C328-0044 |
| Compound Name: | N-[(5-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-4-methoxybenzamide |
| Molecular Weight: | 432.88 |
| Molecular Formula: | C19 H17 Cl N4 O4 S |
| Smiles: | COc1ccc(cc1)C(NCc1nnc(o1)SCC(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8813 |
| logD: | 2.8812 |
| logSw: | -3.6669 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.108 |
| InChI Key: | HAGKYUIXLWNMDU-UHFFFAOYSA-N |