N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-1129 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
| Molecular Weight: | 423.56 |
| Molecular Formula: | C25 H33 N3 O3 |
| Smiles: | CCN(CCCNC(CCC(N1CCOc2ccc(C)cc12)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5421 |
| logD: | 3.5098 |
| logSw: | -3.6414 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.278 |
| InChI Key: | YTTNVFYLPFUYQU-UHFFFAOYSA-N |