9-[2-(4-chlorophenyl)ethyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
9-[2-(4-chlorophenyl)ethyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
9-[2-(4-chlorophenyl)ethyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0377 |
| Compound Name: | 9-[2-(4-chlorophenyl)ethyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C25 H20 Cl N O3 |
| Smiles: | C(CN1Cc2c(ccc3C(=CC(=O)Oc23)c2ccccc2)OC1)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2419 |
| logD: | 5.194 |
| logSw: | -5.658 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.621 |
| InChI Key: | BKPHPUZHEHCIDD-UHFFFAOYSA-N |