5-[4-(cycloheptylamino)-4-oxobutyl]-N-(3-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[4-(cycloheptylamino)-4-oxobutyl]-N-(3-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[4-(cycloheptylamino)-4-oxobutyl]-N-(3-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0996 |
| Compound Name: | 5-[4-(cycloheptylamino)-4-oxobutyl]-N-(3-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C20 H25 F N4 O2 S |
| Smiles: | C1CCCC(CC1)NC(CCCc1nnc(C(Nc2cccc(c2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8233 |
| logD: | 3.8201 |
| logSw: | -3.9932 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.585 |
| InChI Key: | GTTGOWCNHLQANO-UHFFFAOYSA-N |