3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-7-(diethylamino)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-7-(diethylamino)-2H-1-benzopyran-2-one
3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-7-(diethylamino)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0077 |
| Compound Name: | 3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-7-(diethylamino)-2H-1-benzopyran-2-one |
| Molecular Weight: | 395.84 |
| Molecular Formula: | C21 H18 Cl N3 O3 |
| Smiles: | CCN(CC)c1ccc2C=C(C(=O)Oc2c1)c1nc(c2ccccc2[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 4.965 |
| logD: | 4.965 |
| logSw: | -4.9902 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.302 |
| InChI Key: | ZQRUWUIGBXZVHD-UHFFFAOYSA-N |