N-[3-(2-ethylpiperidin-1-yl)propyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzamide
Chemical Structure Depiction of
N-[3-(2-ethylpiperidin-1-yl)propyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzamide
N-[3-(2-ethylpiperidin-1-yl)propyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzamide
Compound characteristics
| Compound ID: | C307-0052 |
| Compound Name: | N-[3-(2-ethylpiperidin-1-yl)propyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzamide |
| Molecular Weight: | 541.67 |
| Molecular Formula: | C33 H36 F N3 O3 |
| Smiles: | CCC1CCCCN1CCCNC(c1ccc(/C=C2/C(N(Cc3ccccc3F)c3ccccc3O2)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6696 |
| logD: | 2.8026 |
| logSw: | -5.4737 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.082 |
| InChI Key: | KXUSORJGNFQLRU-MHZLTWQESA-N |