4-{[(2-fluorophenyl)methyl]amino}-3-nitro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[(2-fluorophenyl)methyl]amino}-3-nitro-2H-1-benzopyran-2-one
4-{[(2-fluorophenyl)methyl]amino}-3-nitro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8012-5044 |
| Compound Name: | 4-{[(2-fluorophenyl)methyl]amino}-3-nitro-2H-1-benzopyran-2-one |
| Molecular Weight: | 314.27 |
| Molecular Formula: | C16 H11 F N2 O4 |
| Smiles: | C(c1ccccc1F)NC1=C(C(=O)Oc2ccccc12)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8565 |
| logD: | 1.3904 |
| logSw: | -3.715 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.893 |
| InChI Key: | HCELFFYCWWCFFU-UHFFFAOYSA-N |