Name: 4-(4-benzylamino-phenyl)-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)N1CC=C(c2ccc(NCc3ccccc3)cc2)CC1Molecular Processing
Molecular formula
C23H28N2O2
Molecular weight
364.49
Exact mass
364.2151
XLogP
5.32
TPSA
41.57
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
27
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
0.348
Molar refractivity
110.61
Supplementary Information
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