N-(4-methyl-2-nitrophenyl)-3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Chemical Structure Depiction of
N-(4-methyl-2-nitrophenyl)-3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carboxamide
N-(4-methyl-2-nitrophenyl)-3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Compound characteristics
| Compound ID: | D429-0066 |
| Compound Name: | N-(4-methyl-2-nitrophenyl)-3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carboxamide |
| Molecular Weight: | 416.43 |
| Molecular Formula: | C24 H20 N2 O5 |
| Smiles: | Cc1ccc(cc1)C1Cc2cc(ccc2C(=O)O1)C(Nc1ccc(C)cc1[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4815 |
| logD: | 4.5873 |
| logSw: | -5.4075 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.265 |
| InChI Key: | PEYLZHJKKSJYPO-JOCHJYFZSA-N |