C1=CC=C(C=C1)C(=O)C2=CN=C3C(=C2C4=CC(=CC=C4)O)C=CC=C3C(F)(F)F
Name: [4-(3-hydroxyphenyl)-8-(trifluoromethyl)quinolin-3-yl]-phenylmethanone
SMILES: C1=CC=C(C=C1)C(=O)C2=CN=C3C(=C2C4=CC(=CC=C4)O)C=CC=C3C(F)(F)F

Molecular Processing

Molecular formula
C23H14F3NO2
Molecular weight
393.36
Exact mass
393.0977
XLogP
5.86
TPSA
50.19
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
29
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.043
Molar refractivity
103.72

Supplementary Information

InChIKey: KENBGHMSTBKWSA-UHFFFAOYSA-N
Synonyme
[4-(3-Hydroxyphenyl)-8-(Trifluoromethyl)Quinolin-3-yl](Phenyl)MethanoneSCHEMBL1124461[4-(3-hydroxy-phenyl)-8-trifluoromethylquinolin-3-yl]-phenyl methanone[4-(3-hydroxyphenyl)-8-(trifluoromethyl)-quinolin-3-yl](phenyl)methanone
Quelle anzeigen →
An 79 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→