4-[2-(2-Amino-4,7-dihydro-4-oxo-1H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoic acid methyl ester
- Product Name4-[2-(2-Amino-4,7-dihydro-4-oxo-1H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoic acid methyl ester
- CAS155405-80-4
- MFC16H16N4O3
- MW312.32
- EINECS1806241-263-5
- MOL File155405-80-4.mol
Chemical Properties
| Melting point | >220 °C |
| Density | 1.44 |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | DMSO (Slightly), Methanol (Very Slightly, Heated) |
| form | Solid |
| pka | 11.21±0.20(Predicted) |
| color | Off-White to Pale Beige |
| InChI | InChI=1S/C16H16N4O3/c1-23-15(22)10-5-2-9(3-6-10)4-7-11-8-18-13-12(11)14(21)20-16(17)19-13/h2-3,5-6,8H,4,7H2,1H3,(H4,17,18,19,20,21) |
| InChIKey | GDEKSBCRJKAARB-UHFFFAOYSA-N |
| SMILES | C(OC)(=O)C1=CC=C(CCC2C3C(=O)NC(N)=NC=3NC=2)C=C1 |