3-ethyl-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
3-ethyl-9-(4-fluoro-3-nitrophenyl)-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
3-ethyl-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: | C202-2300 |
| Compound Name: | 3-ethyl-9-(4-fluoro-3-nitrophenyl)-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 384.36 |
| Molecular Formula: | C20 H17 F N2 O5 |
| Smiles: | CCC1=C(C)c2ccc3c(CN(CO3)c3ccc(c(c3)[N+]([O-])=O)F)c2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 4.5259 |
| logD: | 4.5259 |
| logSw: | -4.5944 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.229 |
| InChI Key: | UGCDAGDZYGIZSZ-UHFFFAOYSA-N |