이름: 6-chloro-2'-phenoxycarbonylspiro[benzofuran-2(3H),4'(2'H)-isoquinoline]
SMILES:
O=C(Oc1ccccc1)N1Cc2ccccc2C2(Cc3ccc(Cl)cc3O2)C1Molecular Processing
Molecular formula
C23H18ClNO3
Molecular weight
391.85
Exact mass
391.0975
XLogP
5.19
TPSA
38.77
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
28
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.174
Molar refractivity
106.78
Supplementary Information
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