7-(diethylamino)-3-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-(diethylamino)-3-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]-2H-1-benzopyran-2-one
7-(diethylamino)-3-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1564-0023 |
| Compound Name: | 7-(diethylamino)-3-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 406.4 |
| Molecular Formula: | C21 H18 N4 O5 |
| Smiles: | CCN(CC)c1ccc2C=C(C(=O)Oc2c1)c1nnc(c2ccc(cc2)[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.9345 |
| logD: | 3.9345 |
| logSw: | -4.1614 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 87.522 |
| InChI Key: | CYIFJCKFAHESIN-UHFFFAOYSA-N |