5-[4-(butylamino)-4-oxobutyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[4-(butylamino)-4-oxobutyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[4-(butylamino)-4-oxobutyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0521 |
| Compound Name: | 5-[4-(butylamino)-4-oxobutyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 380.89 |
| Molecular Formula: | C17 H21 Cl N4 O2 S |
| Smiles: | CCCCNC(CCCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.237 |
| logD: | 3.2337 |
| logSw: | -3.6012 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.642 |
| InChI Key: | RMHAGIUFPPEAOG-UHFFFAOYSA-N |