CCCCCCCN1C(=O)CC(C)(C)c2cc(C#Cc3ccc(C(=O)OCC)cc3)ccc21
SMILES: CCCCCCCN1C(=O)CC(C)(C)c2cc(C#Cc3ccc(C(=O)OCC)cc3)ccc21

Molecular Processing

Molecular formula
C29H35NO3
Molecular weight
445.6
Exact mass
445.2617
XLogP
6.25
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
33
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.448
Molar refractivity
133.58

Supplementary Information

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