3-benzyl-6-chloro-9-[(3,4-dimethoxyphenyl)methyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
3-benzyl-6-chloro-9-[(3,4-dimethoxyphenyl)methyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
3-benzyl-6-chloro-9-[(3,4-dimethoxyphenyl)methyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0225 |
| Compound Name: | 3-benzyl-6-chloro-9-[(3,4-dimethoxyphenyl)methyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 491.97 |
| Molecular Formula: | C28 H26 Cl N O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1cc(c1c2CN(Cc2ccc(c(c2)OC)OC)CO1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9044 |
| logD: | 5.2804 |
| logSw: | -5.9883 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.102 |
| InChI Key: | DIZJWQWPHRBQAA-UHFFFAOYSA-N |