N-(4-methyl-2-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Chemical Structure Depiction of
N-(4-methyl-2-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
N-(4-methyl-2-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Compound characteristics
| Compound ID: | D136-0069 |
| Compound Name: | N-(4-methyl-2-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide |
| Molecular Weight: | 402.41 |
| Molecular Formula: | C23 H18 N2 O5 |
| Smiles: | Cc1ccc(c(c1)[N+]([O-])=O)NC(c1ccc2C(=O)OC(Cc2c1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0624 |
| logD: | 4.1682 |
| logSw: | -4.7455 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.265 |
| InChI Key: | NFRVZHWJQFDIFO-OAQYLSRUSA-N |