3-(5-anilino-1,3,4-thiadiazol-2-yl)-6,8-dichloro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(5-anilino-1,3,4-thiadiazol-2-yl)-6,8-dichloro-2H-1-benzopyran-2-one
3-(5-anilino-1,3,4-thiadiazol-2-yl)-6,8-dichloro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1711-1420 |
| Compound Name: | 3-(5-anilino-1,3,4-thiadiazol-2-yl)-6,8-dichloro-2H-1-benzopyran-2-one |
| Molecular Weight: | 390.25 |
| Molecular Formula: | C17 H9 Cl2 N3 O2 S |
| Smiles: | C1=C(C(=O)Oc2c1cc(cc2[Cl])[Cl])c1nnc(Nc2ccccc2)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.3329 |
| logD: | 5.3329 |
| logSw: | -6.0647 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.03 |
| InChI Key: | DBUXDZBOLSBAMS-UHFFFAOYSA-N |