5-[(2-ethylbutanamido)methyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(2-ethylbutanamido)methyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-[(2-ethylbutanamido)methyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L061-0604 |
| Compound Name: | 5-[(2-ethylbutanamido)methyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 332.42 |
| Molecular Formula: | C16 H20 N4 O2 S |
| Smiles: | CCC(CC)C(NCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4747 |
| logD: | 2.4746 |
| logSw: | -2.8664 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.014 |
| InChI Key: | MDAYTBOMLSJYOI-UHFFFAOYSA-N |