N-(2-methylphenyl)-5-(4-oxo-4-{[3-(piperidin-1-yl)propyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-(4-oxo-4-{[3-(piperidin-1-yl)propyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-(4-oxo-4-{[3-(piperidin-1-yl)propyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0934 |
| Compound Name: | N-(2-methylphenyl)-5-(4-oxo-4-{[3-(piperidin-1-yl)propyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C22 H31 N5 O2 S |
| Smiles: | Cc1ccccc1NC(c1nnc(CCCC(NCCCN2CCCCC2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9664 |
| logD: | -0.6877 |
| logSw: | -2.3718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.655 |
| InChI Key: | WIGGFSYZRDXHQP-UHFFFAOYSA-N |