6-chloro-9-[(3,4-dimethoxyphenyl)methyl]-4-ethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
6-chloro-9-[(3,4-dimethoxyphenyl)methyl]-4-ethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
6-chloro-9-[(3,4-dimethoxyphenyl)methyl]-4-ethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0217 |
| Compound Name: | 6-chloro-9-[(3,4-dimethoxyphenyl)methyl]-4-ethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 415.87 |
| Molecular Formula: | C22 H22 Cl N O5 |
| Smiles: | CCC1=CC(=O)Oc2c1cc(c1c2CN(Cc2ccc(c(c2)OC)OC)CO1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3579 |
| logD: | 3.7339 |
| logSw: | -4.6578 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.86 |
| InChI Key: | DWFKDPDWBMLJME-UHFFFAOYSA-N |