4-({5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}carbamoyl)phenyl acetate
Chemical Structure Depiction of
4-({5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}carbamoyl)phenyl acetate
4-({5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}carbamoyl)phenyl acetate
Compound characteristics
| Compound ID: | Y030-8810 |
| Compound Name: | 4-({5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}carbamoyl)phenyl acetate |
| Molecular Weight: | 403.84 |
| Molecular Formula: | C18 H14 Cl N3 O4 S |
| Smiles: | CC(=O)Oc1ccc(cc1)C(Nc1nnc(COc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6216 |
| logD: | 2.8962 |
| logSw: | -4.3077 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.349 |
| InChI Key: | PPPOJPSFNLUEED-UHFFFAOYSA-N |