CC(=O)n1cc(CCCN2CCN(c3ccc(Cl)cc3)CC2)c2c1CCCC2
SMILES: CC(=O)n1cc(CCCN2CCN(c3ccc(Cl)cc3)CC2)c2c1CCCC2

Molecular Processing

Molecular formula
C23H30ClN3O
Molecular weight
399.97
Exact mass
399.2077
XLogP
4.44
TPSA
28.48
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
115.8

Supplementary Information

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