5-({4-[(3-methylbutyl)carbamoyl]phenoxy}methyl)-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-({4-[(3-methylbutyl)carbamoyl]phenoxy}methyl)-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-({4-[(3-methylbutyl)carbamoyl]phenoxy}methyl)-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L083-0839 |
| Compound Name: | 5-({4-[(3-methylbutyl)carbamoyl]phenoxy}methyl)-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Smiles: | CC(C)CCNC(c1ccc(cc1)OCc1nnc(C(Nc2ccccc2C)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.796 |
| logD: | 3.7959 |
| logSw: | -3.938 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.385 |
| InChI Key: | ZGRBFPHAXXITLI-UHFFFAOYSA-N |