5-cyclopropyl-N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-cyclopropyl-N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
5-cyclopropyl-N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F854-1355 |
| Compound Name: | 5-cyclopropyl-N-(3-{[(4-ethoxyphenyl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C22 H22 N4 O3 S |
| Smiles: | CCOc1ccc(CNC(c2cccc(c2)NC(c2nnc(C3CC3)s2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7916 |
| logD: | 3.7914 |
| logSw: | -3.9132 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.622 |
| InChI Key: | JRPQSPPEIXIRGB-UHFFFAOYSA-N |