2-[(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2-nitrophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2-nitrophenyl)quinazolin-4(3H)-one
2-[(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2-nitrophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 3456-0446 |
| Compound Name: | 2-[(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2-nitrophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 438.44 |
| Molecular Formula: | C25 H18 N4 O4 |
| Smiles: | CCN1C(C(=C\C2=Nc3ccccc3C(N2c2ccccc2[N+]([O-])=O)=O)\c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3931 |
| logD: | 3.3931 |
| logSw: | -3.9674 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.839 |
| InChI Key: | BMKYBCFOOHUKQA-UHFFFAOYSA-N |