N-(2-methylphenyl)-5-(4-{[3-(morpholin-4-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-(4-{[3-(morpholin-4-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-(4-{[3-(morpholin-4-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0854 |
| Compound Name: | N-(2-methylphenyl)-5-(4-{[3-(morpholin-4-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 431.56 |
| Molecular Formula: | C21 H29 N5 O3 S |
| Smiles: | Cc1ccccc1NC(c1nnc(CCCC(NCCCN2CCOCC2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8595 |
| logD: | 0.436 |
| logSw: | -2.1619 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.564 |
| InChI Key: | YDKXVHQJQWOGRY-UHFFFAOYSA-N |