4-methyl-2-oxo-3-phenyl-2H-1-benzopyran-6-yl 4-nitrobenzoate
Chemical Structure Depiction of
4-methyl-2-oxo-3-phenyl-2H-1-benzopyran-6-yl 4-nitrobenzoate
4-methyl-2-oxo-3-phenyl-2H-1-benzopyran-6-yl 4-nitrobenzoate
Compound characteristics
| Compound ID: | G856-6304 |
| Compound Name: | 4-methyl-2-oxo-3-phenyl-2H-1-benzopyran-6-yl 4-nitrobenzoate |
| Molecular Weight: | 401.37 |
| Molecular Formula: | C23 H15 N O6 |
| Smiles: | CC1=C(C(=O)Oc2ccc(cc12)OC(c1ccc(cc1)[N+]([O-])=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7501 |
| logD: | 4.7501 |
| logSw: | -4.6906 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.648 |
| InChI Key: | UDRCZHOQWFIZPC-UHFFFAOYSA-N |