| 融点 |
67-71°C |
| 沸点 |
536.0±60.0 °C(Predicted) |
| 比重(密度) |
1.36±0.1 g/cm3(Predicted) |
| 貯蔵温度 |
-20°C Freezer |
| 溶解性 |
Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
| 酸解離定数(Pka) |
9.80±0.10(Predicted) |
| 外見 |
Solid |
| 色 |
White to Off-White |
| 主な用途 |
pharmaceutical small molecule |
| InChI |
1S/C16H16ClN3OS/c1-9-7-18-14(10(2)15(9)17)8-22-16-19-12-5-4-11(21-3)6-13(12)20-16/h4-7H,8H2,1-3H3,(H,19,20) |
| InChIKey |
UPVARCHBWKDWRW-UHFFFAOYSA-N |
| SMILES |
CC1=C(Cl)C(C)=C(CSC2=NC3=C(N2)C=C(OC)C=C3)N=C1 |