N-(3-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Chemical Structure Depiction of
N-(3-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
N-(3-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Compound characteristics
| Compound ID: | D136-0064 |
| Compound Name: | N-(3-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide |
| Molecular Weight: | 388.38 |
| Molecular Formula: | C22 H16 N2 O5 |
| Smiles: | C1C(c2ccccc2)OC(c2ccc(cc12)C(Nc1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6434 |
| logD: | 4.5283 |
| logSw: | -4.8042 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.264 |
| InChI Key: | MAWAZQBWUQGXSM-HXUWFJFHSA-N |