4-{[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]carbamoyl}phenyl acetate
Chemical Structure Depiction of
4-{[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]carbamoyl}phenyl acetate
4-{[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]carbamoyl}phenyl acetate
Compound characteristics
| Compound ID: | Y030-6995 |
| Compound Name: | 4-{[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]carbamoyl}phenyl acetate |
| Molecular Weight: | 331.27 |
| Molecular Formula: | C12 H8 F3 N3 O3 S |
| Smiles: | CC(=O)Oc1ccc(cc1)C(Nc1nnc(C(F)(F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5154 |
| logD: | -0.4407 |
| logSw: | -2.9758 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.626 |
| InChI Key: | HKXUSPFRDQNTNQ-UHFFFAOYSA-N |