3-[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]-7-hydroxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]-7-hydroxy-2H-1-benzopyran-2-one
3-[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]-7-hydroxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1814-2038 |
| Compound Name: | 3-[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]-7-hydroxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 355.34 |
| Molecular Formula: | C17 H10 F N3 O3 S |
| Smiles: | C1=C(C(=O)Oc2cc(ccc12)O)c1nnc(Nc2ccccc2F)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.766 |
| logD: | 3.6932 |
| logSw: | -4.2918 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.265 |
| InChI Key: | VRIWYIIXKDOZQR-UHFFFAOYSA-N |