4-[(5-benzyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl acetate
Chemical Structure Depiction of
4-[(5-benzyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl acetate
4-[(5-benzyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl acetate
Compound characteristics
| Compound ID: | Y030-8812 |
| Compound Name: | 4-[(5-benzyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl acetate |
| Molecular Weight: | 353.4 |
| Molecular Formula: | C18 H15 N3 O3 S |
| Smiles: | CC(=O)Oc1ccc(cc1)C(Nc1nnc(Cc2ccccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2157 |
| logD: | 3.0376 |
| logSw: | -3.5685 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.849 |
| InChI Key: | DEVPHEPJBVFWJF-UHFFFAOYSA-N |