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 | C30H38N4O4S2 |
| Molecular Weight | 582.78 g/mol |
| Exact Mass | 582.2335 Da |
| InChI |
InChI=1S/C30H38N4O4S2/c1-9-19-33-23-17-13-11-15-21(23)29(25(33)35,31-39(37)27(3,4)5)30(32-40(38)28(6,7)8)22-16-12-14-18-24(22)34(20-10-2)26(30)36/h9-18,31-32H,1-2,19-20H2,3-8H3/t29-,30+,39-,40-/m1/s1
|
| InChIKey |
ICDJDZJUYXWEGC-GDJNFJMTSA-N
|
| SMILES |
C=CCN1C2=C(C=CC=C2)[C@@](C1=O)([C@@]3(C4=C(C=CC=C4)N(CC=C)C3=O)N[S@](=O)C(C)(C)C)N[S@](=O)C(C)(C)C
|
| Number of Atoms | 78 |
| Number of H-Bond Acceptors | 8 |
| Number of H-Bond Donors | 2 |
| Atoms in the Largest π-System | 9 |
| XLogP | 0.8 |
