ethyl 4-(3-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}propanamido)benzoate
Chemical Structure Depiction of
ethyl 4-(3-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}propanamido)benzoate
ethyl 4-(3-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}propanamido)benzoate
Compound characteristics
| Compound ID: | G713-0024 |
| Compound Name: | ethyl 4-(3-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}propanamido)benzoate |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CCc1nnc(C(Nc2ccc(C)cc2)=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9419 |
| logD: | 3.9418 |
| logSw: | -3.9127 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.96 |
| InChI Key: | AUCUYQFQDKLXTH-UHFFFAOYSA-N |