2-ethyl-3-{[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]methyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
2-ethyl-3-{[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]methyl}quinazolin-4(3H)-one
2-ethyl-3-{[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]methyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | F387-0155 |
| Compound Name: | 2-ethyl-3-{[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]methyl}quinazolin-4(3H)-one |
| Molecular Weight: | 400.39 |
| Molecular Formula: | C22 H16 N4 O4 |
| Smiles: | CCC1=Nc2ccccc2C(N1Cc1nc(C2=Cc3ccccc3OC2=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5166 |
| logD: | 2.5165 |
| logSw: | -3.0401 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.067 |
| InChI Key: | MBICIQDZEWGIBI-UHFFFAOYSA-N |