1-(4-Methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylic acid ethyl ester
- Product Name1-(4-Methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylic acid ethyl ester
- CAS503614-91-3
- MFC27H28N4O5
- MW488.54
- EINECS700-890-7
- MOL File503614-91-3.mol
Chemical Properties
Melting point | 175 - 180°C |
Boiling point | 758.7±60.0 °C(Predicted) |
Density | 1.34 |
vapor pressure | 0.001Pa at 25℃ |
storage temp. | Sealed in dry,Room Temperature |
solubility | Chloroform (Slightly), Methanol (Slightly) |
pka | 0.78±0.20(Predicted) |
form | Solid |
color | White to Pale Beige |
InChI | InChI=1S/C27H28N4O5/c1-3-36-27(34)24-22-15-17-30(19-9-7-18(8-10-19)29-16-5-4-6-23(29)32)26(33)25(22)31(28-24)20-11-13-21(35-2)14-12-20/h7-14H,3-6,15-17H2,1-2H3 |
InChIKey | PULNLYVCJSOXKS-UHFFFAOYSA-N |
SMILES | C1(=O)N(C2=CC=C(N3CCCCC3=O)C=C2)CCC2C(C(OCC)=O)=NN(C3=CC=C(OC)C=C3)C1=2 |
LogP | 172 at 22.8℃ |