N-(4-methoxyphenyl)-5-({2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-5-({2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-methoxyphenyl)-5-({2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0088 |
| Compound Name: | N-(4-methoxyphenyl)-5-({2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C22 H24 N6 O4 S |
| Smiles: | COc1ccc(cc1)NC(c1nnc(COCC(N2CCN(CC2)c2ccccn2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9347 |
| logD: | 1.9258 |
| logSw: | -2.5653 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.2 |
| InChI Key: | JCGGQLUOBKLYHJ-UHFFFAOYSA-N |