N-{3-[benzyl(propan-2-yl)amino]propyl}-4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-{3-[benzyl(propan-2-yl)amino]propyl}-4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-{3-[benzyl(propan-2-yl)amino]propyl}-4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-0258 |
| Compound Name: | N-{3-[benzyl(propan-2-yl)amino]propyl}-4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
| Molecular Weight: | 458 |
| Molecular Formula: | C25 H32 Cl N3 O3 |
| Smiles: | CC(C)N(CCCNC(CCC(N1CCOc2ccc(cc12)[Cl])=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2856 |
| logD: | 1.2819 |
| logSw: | -3.6383 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.885 |
| InChI Key: | IJHFAMNSWZRVOJ-UHFFFAOYSA-N |