CC(C)C1=C(C(=O)C2=C(O1)C(=C(C=C2)N)O)C3=CC=C(C=C3)Cl
الاسم: 7-amino-3-(4-chlorophenyl)-8-hydroxy-2-propan-2-ylchromen-4-one
SMILES: CC(C)C1=C(C(=O)C2=C(O1)C(=C(C=C2)N)O)C3=CC=C(C=C3)Cl

Molecular Processing

Molecular formula
C18H16ClNO3
Molecular weight
329.78
Exact mass
329.0819
XLogP
4.52
TPSA
76.46
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
93.1

Supplementary Information

InChIKey: ZCKQYUOUPFBEFS-UHFFFAOYSA-N
مرادفات
SCHEMBL3581362ZCKQYUOUPFBEFS-UHFFFAOYSA-N7-Amino-3-(4-chlorophenyl)-8-hydroxy-2-isopropyl-chromen-4-one
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