N-[(2,3-dimethoxyphenyl)methyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-[(2,3-dimethoxyphenyl)methyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-1205 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C22 H26 N2 O5 |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CCC(NCc1cccc(c1OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6931 |
| logD: | 2.6931 |
| logSw: | -3.0038 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.794 |
| InChI Key: | XBHHXTKSDODSDB-UHFFFAOYSA-N |