CC(C)C(NC(C1CCNCC1)C1C2CCC(C2)C1(C)C)C(C)CC1C2CCC(C2)C1(C)C
SMILES: CC(C)C(NC(C1CCNCC1)C1C2CCC(C2)C1(C)C)C(C)CC1C2CCC(C2)C1(C)C

Molecular Processing

Molecular formula
C31H56N2
Molecular weight
456.8
Exact mass
456.4443
XLogP
7.14
TPSA
24.06
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
8
Heavy atoms
33
Rings
5
Aromatic rings
0
Saturated rings
5
Aliphatic rings
5
Stereo centers
9
Undefined stereo
9
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
1
Molar refractivity
141.13

Supplementary Information

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