CC(C)(C)C(=O)C1=C(C2=CC(=C(N=C2O1)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Cl)N
Название: 1-[3-amino-5-(4-chlorophenyl)-6-(2,4-dichlorophenyl)furo[2,3-b]pyridin-2-yl]-2,2-dimethylpropan-1-one
SMILES: CC(C)(C)C(=O)C1=C(C2=CC(=C(N=C2O1)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Cl)N

Molecular Processing

Molecular formula
C24H19Cl3N2O2
Molecular weight
473.79
Exact mass
472.0512
XLogP
7.93
TPSA
69.12
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
128.11

Supplementary Information

InChIKey: ZBQRPVYKKFQYEU-UHFFFAOYSA-N
Синонимы
CHEMBL10893511-(3-amino-5-(4-chlorophenyl)-6-(2,4-dichlorophenyl)furo[2,3-b]pyridin-2-yl)-2,2-dimethylpropan-1-one1-[3-Amino-5-(4-chlorophenyl)-6-(2,4-dichlorophenyl)furo[2,3-b]pyridin-2-yl]-2,2-dimethylpropan-1-oneSCHEMBL1628716ZBQRPVYKKFQYEU-UHFFFAOYSA-NBDBM50314115
Источник →
Участвует в 6 реакциях→

Расширенный поиск

Поиск подструктуры→Поиск по сходству→