5-{[3-(4-methoxyphenyl)propanamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[3-(4-methoxyphenyl)propanamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-{[3-(4-methoxyphenyl)propanamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L061-0611 |
| Compound Name: | 5-{[3-(4-methoxyphenyl)propanamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C20 H20 N4 O3 S |
| Smiles: | COc1ccc(CCC(NCc2nnc(C(Nc3ccccc3)=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.856 |
| logD: | 2.856 |
| logSw: | -3.5859 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.073 |
| InChI Key: | VUHRPSNMVLEWCF-UHFFFAOYSA-N |