7-(diethylamino)-3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-(diethylamino)-3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
7-(diethylamino)-3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0113 |
| Compound Name: | 7-(diethylamino)-3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 375.43 |
| Molecular Formula: | C22 H21 N3 O3 |
| Smiles: | CCN(CC)c1ccc2C=C(C(=O)Oc2c1)c1nc(c2ccccc2C)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.8168 |
| logD: | 4.8167 |
| logSw: | -4.7425 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.302 |
| InChI Key: | FFAIJXBYBBEFKH-UHFFFAOYSA-N |