이름: 2-amino-N-{4-[1-methyl-1-(1-methyl-piperidin-4-yl)ethyl]phenyl}benzamide
SMILES:
CN1CCC(C(C)(C)c2ccc(NC(=O)c3ccccc3N)cc2)CC1Molecular Processing
Molecular formula
C22H29N3O
Molecular weight
351.49
Exact mass
351.2311
XLogP
4.14
TPSA
58.36
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
108.5
Supplementary Information
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