CC(c1ccccc1)N1CCCC(CN2CCN(C(=O)OCc3ccccc3)CC2)C1
SMILES: CC(c1ccccc1)N1CCCC(CN2CCN(C(=O)OCc3ccccc3)CC2)C1

Molecular Processing

Molecular formula
C26H35N3O2
Molecular weight
421.59
Exact mass
421.2729
XLogP
4.41
TPSA
36.02
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
31
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
123.79

Supplementary Information

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