N-{3-[benzyl(methyl)amino]propyl}-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]propyl}-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-{3-[benzyl(methyl)amino]propyl}-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-1128 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C24 H31 N3 O3 |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CCC(NCCCN(C)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2846 |
| logD: | 0.7873 |
| logSw: | -2.948 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.382 |
| InChI Key: | IVABEDKSPPNMPM-UHFFFAOYSA-N |