N-(4-methoxyphenyl)-5-(4-{[(3-methylphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-5-(4-{[(3-methylphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-methoxyphenyl)-5-(4-{[(3-methylphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0073 |
| Compound Name: | N-(4-methoxyphenyl)-5-(4-{[(3-methylphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C22 H24 N4 O3 S |
| Smiles: | Cc1cccc(CNC(CCCc2nnc(C(Nc3ccc(cc3)OC)=O)s2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5006 |
| logD: | 3.5005 |
| logSw: | -3.8546 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.073 |
| InChI Key: | ZKSADENXDGSKFX-UHFFFAOYSA-N |