7-benzyl-3-[(3-chlorophenyl)methyl]-6,10-dimethyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Chemical Structure Depiction of
7-benzyl-3-[(3-chlorophenyl)methyl]-6,10-dimethyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
7-benzyl-3-[(3-chlorophenyl)methyl]-6,10-dimethyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Compound characteristics
| Compound ID: | D144-0566 |
| Compound Name: | 7-benzyl-3-[(3-chlorophenyl)methyl]-6,10-dimethyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one |
| Molecular Weight: | 445.95 |
| Molecular Formula: | C27 H24 Cl N O3 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1cc1CN(Cc3cccc(c3)[Cl])COc1c2C |
| Stereo: | ACHIRAL |
| logP: | 6.5381 |
| logD: | 5.9845 |
| logSw: | -6.1222 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.841 |
| InChI Key: | XLONEKKEKOUECQ-UHFFFAOYSA-N |