5-{4-[(butan-2-yl)amino]-4-oxobutyl}-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{4-[(butan-2-yl)amino]-4-oxobutyl}-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-{4-[(butan-2-yl)amino]-4-oxobutyl}-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0402 |
| Compound Name: | 5-{4-[(butan-2-yl)amino]-4-oxobutyl}-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 380.89 |
| Molecular Formula: | C17 H21 Cl N4 O2 S |
| Smiles: | CCC(C)NC(CCCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1789 |
| logD: | 3.1756 |
| logSw: | -3.6167 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.242 |
| InChI Key: | KHQFYVVXHYTBDE-NSHDSACASA-N |