methyl {3-[(3-chlorophenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}acetate
Chemical Structure Depiction of
methyl {3-[(3-chlorophenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}acetate
methyl {3-[(3-chlorophenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}acetate
Compound characteristics
| Compound ID: | D144-0572 |
| Compound Name: | methyl {3-[(3-chlorophenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}acetate |
| Molecular Weight: | 427.88 |
| Molecular Formula: | C23 H22 Cl N O5 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2c1cc1CN(Cc3cccc(c3)[Cl])COc1c2C |
| Stereo: | ACHIRAL |
| logP: | 4.6017 |
| logD: | 4.0481 |
| logSw: | -4.7435 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.692 |
| InChI Key: | KTNIBNVJWNIVDJ-UHFFFAOYSA-N |