CC1=C(C=C(C=C1)N)NC2=NC=CC(=C2)C3=CN=CC=C3
Name: 4-methyl-3-N-(4-pyridin-3-yl-2-pyridinyl)benzene-1,3-diamine
SMILES: CC1=C(C=C(C=C1)N)NC2=NC=CC(=C2)C3=CN=CC=C3

Molecular Processing

Molecular formula
C17H16N4
Molecular weight
276.34
Exact mass
276.1375
XLogP
3.78
TPSA
63.83
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.059
Molar refractivity
86.34

Supplementary Information

InChIKey: UHSRXGXXAUPZSI-UHFFFAOYSA-N
Synonyme
SCHEMBL2924553UHSRXGXXAUPZSI-UHFFFAOYSA-N4-methyl-3-[4-(3-pyridyl)pyridin-2-ylamino]anilineN-(5-amino-2-methylphenyl)-4-(3-pyridyl)-2-pyridineamineN-(5-amino-2-methylphenyl)-4-(3-pyridinyl)-2-pyridineamine
Quelle anzeigen →
An 4 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→