9-(4-fluoro-3-nitrophenyl)-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
9-(4-fluoro-3-nitrophenyl)-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
9-(4-fluoro-3-nitrophenyl)-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | E754-0069 |
| Compound Name: | 9-(4-fluoro-3-nitrophenyl)-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 356.31 |
| Molecular Formula: | C18 H13 F N2 O5 |
| Smiles: | CC1=CC(=O)Oc2c1ccc1c2CN(CO1)c1ccc(c(c1)[N+]([O-])=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.6039 |
| logD: | 3.6039 |
| logSw: | -4.1473 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.715 |
| InChI Key: | IHEFIMKVEHGESE-UHFFFAOYSA-N |