5,10,15-tris(3,5-dicarboxylatophenyl)-20-phenylporphyrin
- CAS:
- Other names:
- SMILES: [O-]C(=O)c1cc(cc(c1)c2c3[nH]c(cc3)c(c4cc(cc(c4)C([O-])=O)C([O-])=O)c5ccc(n5)c(c6[nH]c(cc6)c(c7ccccc7)c8ccc2n8)c9cc(cc(c9)C([O-])=O)C([O-])=O)C([O-])=O
Properties
| MW |
HBA |
HBD |
LogP |
TPSA |
Rot. |
Comp. |
Fsp3C |
Brutto formula |
| 872.75 |
8 |
2 |
-2.95 |
297.0799999999999 |
10 |
225 |
0.00 |
C50H24N4O12------ |
Availability
| Suppliers |
Supplier IDs |
Storage |
Storage ID |
Quantity |
Class |
Added |
|
|
|
SF_C972 |
None |
|
Jan. 1, 2023 |
Bar codes
| Plate barcode |
Sample barcode |
|
|
PAINS
| Identified PAINS |
| Not checked |
Supramolecules
| Name | log K | SD | pH | T(°C) | Method | Ref |
| [a-Cyclodextrin](1).[5,10,15-tris(3,5-dicarboxylatophenyl)-20-phenylporphyrin] |
1.52 |
0.60 |
7.0 |
25.0 |
Isothermal titration calorimetry |
Koji Kano 2005 |
| [b-Cyclodextrin](1).[5,10,15-tris(3,5-dicarboxylatophenyl)-20-phenylporphyrin] |
3.08 |
2.00 |
7.0 |
25.0 |
Isothermal titration calorimetry |
Koji Kano 2005 |
| [Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin isomeric purity >80 %](1).[5,10,15-tris(3,5-dicarboxylatophenyl)-20-phenylporphyrin] |
4.08 |
3.00 |
7.0 |
25.0 |
Isothermal titration calorimetry |
Koji Kano 2005 |
| [2,3-DMe-b-CD](1).[5,10,15-tris(3,5-dicarboxylatophenyl)-20-phenylporphyrin] |
6.93 |
5.70 |
7.0 |
25.0 |
Isothermal titration calorimetry |
Koji Kano 2005 |
| [Heptakis(2,3,6-tri-O-Methyl)-b-Cyclodextrin](1).[5,10,15-tris(3,5-dicarboxylatophenyl)-20-phenylporphyrin] |
6.84 |
5.60 |
7.0 |
25.0 |
Isothermal titration calorimetry |
Koji Kano 2005 |
| [g-Cyclodextrin](1).[5,10,15-tris(3,5-dicarboxylatophenyl)-20-phenylporphyrin] |
2.81 |
1.48 |
7.0 |
25.0 |
Isothermal titration calorimetry |
Koji Kano 2005 |
| [Octakis(2,3,6-tri-O-Methyl)-g-Cyclodextrin](1).[5,10,15-tris(3,5-dicarboxylatophenyl)-20-phenylporphyrin] |
4.46 |
3.00 |
7.0 |
25.0 |
Isothermal titration calorimetry |
Koji Kano 2005 |