iodotrimethyl 2-(p-hexylaminophenyl)-3,3-dimethyl-5-carboethoxy-3H-indole ammonium
- CAS:
- Other names:
- SMILES: [NH4+].CCCCCCNc1ccc(cc1)C2N(I)c3c(C)c(C)c(c(C)c3C2(C)C)C(=O)OCC
Properties
| MW |
HBA |
HBD |
LogP |
TPSA |
Rot. |
Comp. |
Fsp3C |
Brutto formula |
| 580.56 |
4 |
2 |
8.48 |
41.57000000000001 |
10 |
140 |
0.54 |
C28H43IN3O2+ |
Availability
| Suppliers |
Supplier IDs |
Storage |
Storage ID |
Quantity |
Class |
Added |
|
|
|
SF_C1401 |
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 |
| [b-Cyclodextrin](3).[iodotrimethyl 2-(p-hexylaminophenyl)-3,3-dimethyl-5-carboethoxy-3H-indole ammonium] |
5.57 |
4.60 |
9.5 |
25.0 |
Fluorescence spectroscopy |
Gilles Durocher 1998 |