Unexpected chiral vicinal tetrasubstituted diamines via borylcopper-mediated homocoupling of isatin imines
Marco Manenti, Leonardo Lo Presti, Giorgio Molteni and Alessandra Silvani
Beilstein J. Org. Chem. 2022, 18, 303–308.
https://doi.org/10.3762/bjoc.18.34
Chemical Information
Calculated using the Chemistry Development Kit 2.12
| Molecular Formula | C26H32Cl2N4O4S2 |
| Molecular Weight | 599.60 g/mol |
| Exact Mass | 598.1242 Da |
| InChI |
InChI=1S/C26H32Cl2N4O4S2/c1-23(2,3)37(35)29-25(17-11-9-15(27)13-19(17)31(7)21(25)33)26(30-38(36)24(4,5)6)18-12-10-16(28)14-20(18)32(8)22(26)34/h9-14,29-30H,1-8H3/t25-,26+,37-,38-/m1/s1
|
| InChIKey |
HOPQZGLCVMRAOQ-BIJUEJNNSA-N
|
| SMILES |
CC(C)(C)[S@@](=O)N[C@@]1(C2=CC=C(C=C2N(C)C1=O)Cl)[C@@]3(C4=CC=C(C=C4N(C)C3=O)Cl)N[S@](=O)C(C)(C)C
|
| Number of Atoms | 70 |
| Number of H-Bond Acceptors | 8 |
| Number of H-Bond Donors | 2 |
| Atoms in the Largest π-System | 9 |
| XLogP | 0.3 |
