6-chloro-9-[(4-methylphenyl)methyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
6-chloro-9-[(4-methylphenyl)methyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
6-chloro-9-[(4-methylphenyl)methyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0103 |
| Compound Name: | 6-chloro-9-[(4-methylphenyl)methyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C25 H20 Cl N O3 |
| Smiles: | Cc1ccc(CN2Cc3c4c(cc(c3OC2)[Cl])C(=CC(=O)O4)c2ccccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8031 |
| logD: | 5.767 |
| logSw: | -5.888 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.327 |
| InChI Key: | JRQDXWXEKXZPOO-UHFFFAOYSA-N |