| Melting point |
170°C |
| alpha |
-95° (c 1, CH3OH) |
| Boiling point |
663.4±50.0 °C(Predicted) |
| Density |
1.25±0.1 g/cm3(Predicted) |
| storage temp. |
under inert gas (nitrogen or Argon) at 2-8°C |
| form |
Powder |
| pka |
12.51±0.40(Predicted) |
| color |
off-white |
| optical activity |
[α]20/D -97.0°, c = 1 in methanol |
| InChI |
1S/C18H20N4O2/c23-17(15-9-3-5-11-19-15)21-13-7-1-2-8-14(13)22-18(24)16-10-4-6-12-20-16/h3-6,9-14H,1-2,7-8H2,(H,21,23)(H,22,24)/t13-,14-/m1/s1 |
| InChIKey |
BVYFDUZVVBXFBQ-ZIAGYGMSSA-N |
| SMILES |
O=C(N[C@@H]1CCCC[C@H]1NC(=O)c2ccccn2)c3ccccn3 |
