CCc1cc2c(cc1N1CCC(=NO)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O
SMILES: CCc1cc2c(cc1N1CCC(=NO)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O

Molecular Processing

Molecular formula
C26H26N4O2
Molecular weight
426.52
Exact mass
426.2056
XLogP
4.9
TPSA
92.48
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
32
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.346
Molar refractivity
125.06

Supplementary Information

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