ethyl 3-{3-[(4-fluorophenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{3-[(4-fluorophenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}propanoate
ethyl 3-{3-[(4-fluorophenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}propanoate
Compound characteristics
| Compound ID: | D144-0531 |
| Compound Name: | ethyl 3-{3-[(4-fluorophenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}propanoate |
| Molecular Weight: | 439.48 |
| Molecular Formula: | C25 H26 F N O5 |
| Smiles: | CCOC(CCC1=C(C)c2cc3CN(Cc4ccc(cc4)F)COc3c(C)c2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8636 |
| logD: | 4.3297 |
| logSw: | -4.6087 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.272 |
| InChI Key: | UJPAAHSWJDZIJO-UHFFFAOYSA-N |