9-[(2-chlorophenyl)methyl]-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
9-[(2-chlorophenyl)methyl]-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
9-[(2-chlorophenyl)methyl]-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | Y040-1672 |
| Compound Name: | 9-[(2-chlorophenyl)methyl]-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 355.82 |
| Molecular Formula: | C20 H18 Cl N O3 |
| Smiles: | CC1=C(C)c2ccc3c(CN(Cc4ccccc4[Cl])CO3)c2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 4.6191 |
| logD: | 4.5634 |
| logSw: | -4.7681 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.429 |
| InChI Key: | WNWWRFODJYHGLM-UHFFFAOYSA-N |