N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-3,4-diethoxybenzamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-3,4-diethoxybenzamide
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-3,4-diethoxybenzamide
Compound characteristics
| Compound ID: | Y030-7010 |
| Compound Name: | N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-3,4-diethoxybenzamide |
| Molecular Weight: | 417.91 |
| Molecular Formula: | C20 H20 Cl N3 O3 S |
| Smiles: | CCOc1ccc(cc1OCC)C(Nc1nnc(Cc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4467 |
| logD: | 4.3955 |
| logSw: | -4.6466 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.519 |
| InChI Key: | ZRUOIKLFHUKTNZ-UHFFFAOYSA-N |