N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-1014 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
| Molecular Weight: | 412.49 |
| Molecular Formula: | C23 H28 N2 O5 |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CCC(NCCc1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.844 |
| logD: | 1.844 |
| logSw: | -2.2224 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.549 |
| InChI Key: | ZYWJKZWWJLNGST-UHFFFAOYSA-N |