9-[(2-chlorophenyl)methyl]-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[4,5]pyrano[3,2-g][1,3]benzoxazin-4(1H)-one
Chemical Structure Depiction of
9-[(2-chlorophenyl)methyl]-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[4,5]pyrano[3,2-g][1,3]benzoxazin-4(1H)-one
9-[(2-chlorophenyl)methyl]-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[4,5]pyrano[3,2-g][1,3]benzoxazin-4(1H)-one
Compound characteristics
| Compound ID: | D144-0554 |
| Compound Name: | 9-[(2-chlorophenyl)methyl]-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[4,5]pyrano[3,2-g][1,3]benzoxazin-4(1H)-one |
| Molecular Weight: | 381.86 |
| Molecular Formula: | C22 H20 Cl N O3 |
| Smiles: | Cc1c2c(CN(Cc3ccccc3[Cl])CO2)cc2C3CCCC=3C(=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 4.9045 |
| logD: | 4.475 |
| logSw: | -4.8772 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.4 |
| InChI Key: | IZMMECCKVACHIO-UHFFFAOYSA-N |