이름: 3-amino-3-(2-chlorophenyl)-5-ethoxy-1,3-dihydroindol-2-one
SMILES:
CCOc1ccc2c(c1)C(N)(c1ccccc1Cl)C(=O)N2Molecular Processing
Molecular formula
C16H15ClN2O2
Molecular weight
302.76
Exact mass
302.0822
XLogP
2.89
TPSA
64.35
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
82.66
Supplementary Information
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