4-({5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}carbamoyl)phenyl acetate
Chemical Structure Depiction of
4-({5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}carbamoyl)phenyl acetate
4-({5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}carbamoyl)phenyl acetate
Compound characteristics
| Compound ID: | Y030-6997 |
| Compound Name: | 4-({5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}carbamoyl)phenyl acetate |
| Molecular Weight: | 383.42 |
| Molecular Formula: | C19 H17 N3 O4 S |
| Smiles: | CC(=O)Oc1ccc(cc1)C(Nc1nnc(Cc2ccc(cc2)OC)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1981 |
| logD: | 3.02 |
| logSw: | -3.5108 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.393 |
| InChI Key: | LUMBDJFHZRSMTR-UHFFFAOYSA-N |