4-amino-N-((4-benzyl-2-morpholinyl)-methyl)-5-chloro-2-ethoxybenzamide
化学名:4-amino-N-((4-benzyl-2-morpholinyl)-methyl)-5-chloro-2-ethoxybenzamide
CAS番号.112885-33-3
英語名:4-amino-N-((4-benzyl-2-morpholinyl)-methyl)-5-chloro-2-ethoxybenzamide
CBNumberCB11338367
MFC21H26ClN3O3
MW403.9
MOL File112885-33-3.mol
4-amino-N-((4-benzyl-2-morpholinyl)-methyl)-5-chloro-2-ethoxybenzamide物理性質
| 融点 | 153-155 °C(Solv: ethanol (64-17-5)) |
| 沸点 | 545.9±50.0 °C(Predicted) |
| 比重(密度) | 1.233±0.06 g/cm3(Predicted) |
| 酸解離定数(Pka) | 13.52±0.46(Predicted) |
| InChI | InChI=1S/C21H26ClN3O3/c1-2-27-20-11-19(23)18(22)10-17(20)21(26)24-12-16-14-25(8-9-28-16)13-15-6-4-3-5-7-15/h3-7,10-11,16H,2,8-9,12-14,23H2,1H3,(H,24,26) |
| InChIKey | LPMRXDXYXHBNIO-UHFFFAOYSA-N |
| SMILES | C(NCC1OCCN(CC2=CC=CC=C2)C1)(=O)C1=CC(Cl)=C(N)C=C1OCC |