5-{[4-(butylcarbamoyl)phenoxy]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[4-(butylcarbamoyl)phenoxy]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[4-(butylcarbamoyl)phenoxy]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L083-0879 |
| Compound Name: | 5-{[4-(butylcarbamoyl)phenoxy]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C22 H24 N4 O3 S |
| Smiles: | CCCCNC(c1ccc(cc1)OCc1nnc(C(Nc2ccccc2C)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5821 |
| logD: | 3.582 |
| logSw: | -3.6201 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.385 |
| InChI Key: | PNWHDPFHPHNMNJ-UHFFFAOYSA-N |