Cc1c(C(=O)N[C@@H](CCCC(=O)N2CCC(C)CC2)c2cccc(C(F)(F)F)c2)cnn1-c1ccc(Cl)cc1
SMILES: Cc1c(C(=O)N[C@@H](CCCC(=O)N2CCC(C)CC2)c2cccc(C(F)(F)F)c2)cnn1-c1ccc(Cl)cc1

Molecular Processing

Molecular formula
C29H32ClF3N4O2
Molecular weight
561.05
Exact mass
560.2166
XLogP
6.75
TPSA
67.23
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
39
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.414
Molar refractivity
143.79

Supplementary Information

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