1-((2S,5R)-5-((7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)-2-methylpiperidin-1-yl)prop-2-en-1-one
- Product Name1-((2S,5R)-5-((7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)-2-methylpiperidin-1-yl)prop-2-en-1-one
- CAS1792180-81-4
- CBNumberCB23142473
- MFC15H19N5O
- MW285.34
- EINECS210-077-2
- MDL NumberMFCD31697544
- MOL File1792180-81-4.mol
Chemical Properties
Density | 1.272±0.06 g/cm3(Predicted) |
storage temp. | room temp |
solubility | DMSO:100.0(Max Conc. mg/mL);350.4(Max Conc. mM) H2O:5.0(Max Conc. mg/mL);17.5(Max Conc. mM) |
pka | 13.03±0.50(Predicted) |
form | powder |
color | white to beige |
InChI | InChI=1S/C15H19N5O/c1-3-13(21)20-8-11(5-4-10(20)2)19-15-12-6-7-16-14(12)17-9-18-15/h3,6-7,9-11H,1,4-5,8H2,2H3,(H2,16,17,18,19)/t10-,11+/m0/s1 |
InChIKey | CBRJPFGIXUFMTM-WDEREUQCSA-N |
SMILES | C(N1C[C@H](NC2N=CN=C3NC=CC3=2)CC[C@@H]1C)(=O)C=C |
FDA UNII | 2OYE00PC25 |