5-[(4-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenoxy)methyl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(4-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenoxy)methyl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[(4-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenoxy)methyl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L083-0864 |
| Compound Name: | 5-[(4-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenoxy)methyl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 476.6 |
| Molecular Formula: | C26 H28 N4 O3 S |
| Smiles: | Cc1ccccc1NC(c1nnc(COc2ccc(cc2)C(NCCC2CCCCC=2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0736 |
| logD: | 4.0735 |
| logSw: | -4.0755 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.306 |
| InChI Key: | DSMISPYRCOMVKT-UHFFFAOYSA-N |