3-[5-(2,4-dichloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[5-(2,4-dichloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)-2H-1-benzopyran-2-one
3-[5-(2,4-dichloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 2203-2829 |
| Compound Name: | 3-[5-(2,4-dichloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)-2H-1-benzopyran-2-one |
| Molecular Weight: | 461.37 |
| Molecular Formula: | C21 H18 Cl2 N4 O2 S |
| Smiles: | CCN(CC)c1ccc2C=C(C(=O)Oc2c1)c1nnc(Nc2ccc(cc2[Cl])[Cl])s1 |
| Stereo: | ACHIRAL |
| logP: | 6.3348 |
| logD: | 6.3347 |
| logSw: | -6.2482 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.384 |
| InChI Key: | GMVWHAQXAFNBRL-UHFFFAOYSA-N |