名称: N-[2-(5-bromo-1-indolinyl)-5-bromophenyl]-4-methyl-1-piperazinecarboxamide
SMILES:
CN1CCN(C(=O)Nc2cc(Br)ccc2N2CCc3cc(Br)ccc32)CC1Molecular Processing
Molecular formula
C20H22Br2N4O
Molecular weight
494.23
Exact mass
492.016
XLogP
4.69
TPSA
38.82
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
27
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
117.08
Supplementary Information
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