8-methoxy-3-[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methoxy-3-[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]-2H-1-benzopyran-2-one
8-methoxy-3-[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 2203-2820 |
| Compound Name: | 8-methoxy-3-[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 381.41 |
| Molecular Formula: | C19 H15 N3 O4 S |
| Smiles: | COc1ccc(cc1)Nc1nnc(C2=Cc3cccc(c3OC2=O)OC)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.0892 |
| logD: | 4.0892 |
| logSw: | -4.4141 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.204 |
| InChI Key: | HMBWKMIJVBSTHY-UHFFFAOYSA-N |