N-{3-[butyl(methyl)amino]propyl}-2-{2-[(3-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
Chemical Structure Depiction of
N-{3-[butyl(methyl)amino]propyl}-2-{2-[(3-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
N-{3-[butyl(methyl)amino]propyl}-2-{2-[(3-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
Compound characteristics
Compound ID: | K788-4987 |
Compound Name: | N-{3-[butyl(methyl)amino]propyl}-2-{2-[(3-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide |
Molecular Weight: | 439.53 |
Molecular Formula: | C25 H30 F N3 O3 |
Smiles: | CCCCN(C)CCCNC(CN1C(/C(=C\c2cccc(c2)F)Oc2ccccc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.5557 |
logD: | 0.9586 |
logSw: | -3.8704 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.69 |
InChI Key: | MUDSDZNSBWJXFY-UHFFFAOYSA-N |