1’,3’,3’-trimethylspiro[2H-1-benzopyran-2,2’-indoline]-6-sulphonate
- CAS:
- Other names:
- SMILES: CN1c2ccccc2C(C)(C)C13Oc4ccc(cc4C=C3)[S]([O-])(=O)=O
Properties
| MW |
HBA |
HBD |
LogP |
TPSA |
Rot. |
Comp. |
Fsp3C |
Brutto formula |
| 356.42 |
4 |
0 |
4.27 |
78.05 |
1 |
169 |
0.26 |
C19H18NO4S- |
Availability
| Suppliers |
Supplier IDs |
Storage |
Storage ID |
Quantity |
Class |
Added |
|
|
|
SF_C665 |
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 |
| [Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin (DS ~14) isomeric purity >50%](1).[1’,3’,3’-trimethylspiro[2H-1-benzopyran-2,2’-indoline]-6-sulphonate] |
3.33 |
2.78 |
6.9 |
40.0 |
UV-vis spectroscopy |
Yoshimi Sueishi 2005 |
| [Heptakis(2,3,6-tri-O-Methyl)-b-Cyclodextrin](1).[1’,3’,3’-trimethylspiro[2H-1-benzopyran-2,2’-indoline]-6-sulphonate] |
2.24 |
0.85 |
6.9 |
40.0 |
UV-vis spectroscopy |
Yoshimi Sueishi 2005 |