3-[(2-chlorophenyl)methyl]-11-methyl-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-11-methyl-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
3-[(2-chlorophenyl)methyl]-11-methyl-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Compound characteristics
| Compound ID: | D144-0045 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-11-methyl-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one |
| Molecular Weight: | 391.85 |
| Molecular Formula: | C23 H18 Cl N O3 |
| Smiles: | Cc1cc2c(CN(Cc3ccccc3[Cl])CO2)c2c1c1ccccc1C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 5.283 |
| logD: | 5.2662 |
| logSw: | -5.8295 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.157 |
| InChI Key: | IOWWTUMVKHBGKZ-UHFFFAOYSA-N |