N-(3-chlorophenyl)-5-[(3,4,5-trimethoxybenzamido)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[(3,4,5-trimethoxybenzamido)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[(3,4,5-trimethoxybenzamido)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L061-0338 |
| Compound Name: | N-(3-chlorophenyl)-5-[(3,4,5-trimethoxybenzamido)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 462.91 |
| Molecular Formula: | C20 H19 Cl N4 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(NCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1893 |
| logD: | 3.1861 |
| logSw: | -3.6754 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.72 |
| InChI Key: | YKBYFOSSFSYHIA-UHFFFAOYSA-N |