| Melting point |
113-115°C |
| Boiling point |
623.8±55.0 °C(Predicted) |
| Density |
1.315±0.06 g/cm3(Predicted) |
| storage temp. |
-20°C Freezer |
| solubility |
Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly) |
| form |
Solid |
| pka |
6.35±0.50(Predicted) |
| color |
White to Light Beige |
| InChI |
InChI=1S/C19H18N2O4S/c1-12(22)14-4-5-15(20-11-14)8-9-25-16-6-2-13(3-7-16)10-17-18(23)21-19(24)26-17/h2-7,11,17H,8-10H2,1H3,(H,21,23,24) |
| InChIKey |
JMLKLMFMQRAJNI-UHFFFAOYSA-N |
| SMILES |
S1C(CC2=CC=C(OCCC3=NC=C(C(C)=O)C=C3)C=C2)C(=O)NC1=O |