5-[(2-ethylbutanamido)methyl]-N-(3-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(2-ethylbutanamido)methyl]-N-(3-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[(2-ethylbutanamido)methyl]-N-(3-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L061-0412 |
| Compound Name: | 5-[(2-ethylbutanamido)methyl]-N-(3-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 350.41 |
| Molecular Formula: | C16 H19 F N4 O2 S |
| Smiles: | CCC(CC)C(NCc1nnc(C(Nc2cccc(c2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8198 |
| logD: | 2.8165 |
| logSw: | -3.2591 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.014 |
| InChI Key: | AEKPBASBUQERDC-UHFFFAOYSA-N |