N-(3-fluorophenyl)-5-(4-{[2-methyl-1-(thiophen-2-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-5-(4-{[2-methyl-1-(thiophen-2-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-fluorophenyl)-5-(4-{[2-methyl-1-(thiophen-2-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-1112 |
| Compound Name: | N-(3-fluorophenyl)-5-(4-{[2-methyl-1-(thiophen-2-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 446.56 |
| Molecular Formula: | C21 H23 F N4 O2 S2 |
| Smiles: | CC(C)C(c1cccs1)NC(CCCc1nnc(C(Nc2cccc(c2)F)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8549 |
| logD: | 3.8516 |
| logSw: | -3.933 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.899 |
| InChI Key: | ILVCTHGOFLWEGA-IBGZPJMESA-N |