CN1CCC(C(C)(C)c2ccc(NC(=O)c3ccccc3NCc3ccncc3)cc2)CC1
SMILES: CN1CCC(C(C)(C)c2ccc(NC(=O)c3ccccc3NCc3ccncc3)cc2)CC1

Molecular Processing

Molecular formula
C28H34N4O
Molecular weight
442.61
Exact mass
442.2733
XLogP
5.57
TPSA
57.26
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
135.65

Supplementary Information

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