名称: 3-[3-(4-methylpiperazin-1-yl)-3-oxo-propyl]-1,5,6,7-tetrahydroindol-4-one
SMILES:
CN1CCN(C(=O)CCc2c[nH]c3c2C(=O)CCC3)CC1Molecular Processing
Molecular formula
C16H23N3O2
Molecular weight
289.38
Exact mass
289.179
XLogP
1.24
TPSA
56.41
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
80.46
Supplementary Information
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