3-[2-(4-fluorophenyl)ethyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Chemical Structure Depiction of
3-[2-(4-fluorophenyl)ethyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
3-[2-(4-fluorophenyl)ethyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Compound characteristics
| Compound ID: | Y040-7501 |
| Compound Name: | 3-[2-(4-fluorophenyl)ethyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one |
| Molecular Weight: | 379.43 |
| Molecular Formula: | C23 H22 F N O3 |
| Smiles: | C1CCC2=C(C1)C(=O)Oc1c2ccc2c1CN(CCc1ccc(cc1)F)CO2 |
| Stereo: | ACHIRAL |
| logP: | 4.8092 |
| logD: | 4.5132 |
| logSw: | -4.8001 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.328 |
| InChI Key: | LKGCXOQRBYWYAE-UHFFFAOYSA-N |