CC1=NC(=C(C=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)I
CAS: 666730-32-1
Name: 4-[(2-iodo-6-methyl-3-pyridinyl)oxy]-6,7-dimethoxyquinoline
SMILES: CC1=NC(=C(C=C1)OC2=C3C=C(C(=CC3=NC=C2)OC)OC)I

Molecular Processing

Molecular formula
C17H15IN2O3
Molecular weight
422.22
Exact mass
422.0127
XLogP
4.35
TPSA
53.47
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.176
Molar refractivity
96.61

Supplementary Information

InChIKey: XUCZRFLQLHPQKU-UHFFFAOYSA-N
Synonyme
SCHEMBL3894186XUCZRFLQLHPQKU-UHFFFAOYSA-NDB-3801454-[(2-Iodo-6-methyl-3-pyridinyl)oxy]-6,7-dimethoxyquinoline4-[(2-Iodo-6-methyl-3-pyridyl)oxy]-6,7-dimethoxy-quinoline4-[(2-Iodo-6-methyl-3-pyridyl)oxy]-6,7-dimethoxyquinoline666730-32-1
Quelle anzeigen →
An 67 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→