2-cyano-3-(1,4-dihydro-1-phenyl-(1)-benzothiopyran-(4,3-C)-pyrazol-3-yl)-3-oxo-N-phenyl-propanamide
- CAS:
- Other names: FCE 24578
- SMILES: O=C(NC1=CC=CC=C1)C(C#N)C(C2=NN(C3=CC=CC=C3)C4=C2CSC5=CC=CC=C54)=O
Properties
| MW |
HBA |
HBD |
LogP |
TPSA |
Rot. |
Comp. |
Fsp3C |
Brutto formula |
| 450.51 |
6 |
1 |
5.18 |
113.08000000000001 |
4 |
225 |
0.08 |
C26H18N4O2S |
Availability
| Suppliers |
Supplier IDs |
Storage |
Storage ID |
Quantity |
Class |
Added |
|
|
|
SF_C1668 |
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](1).[2-cyano-3-(1,4-dihydro-1-phenyl-(1)-benzothiopyran-(4,3-C)-pyrazol-3-yl)-3-oxo-N-phenyl-propanamide] |
2.84 |
|
7.4 |
37.0 |
UV-vis spectroscopy |
Roberto DePonti 1991 |
| [b-Cyclodextrin](1).[2-cyano-3-(1,4-dihydro-1-phenyl-(1)-benzothiopyran-(4,3-C)-pyrazol-3-yl)-3-oxo-N-phenyl-propanamide] |
3.02 |
|
7.4 |
37.0 |
Polarography |
Roberto DePonti 1991 |