C1CN(CCN1)C2=NN3C(=NN=C3C(F)(F)F)C=C2
CAS: 338748-56-4
الاسم: 6-piperazin-1-yl-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
SMILES: C1CN(CCN1)C2=NN3C(=NN=C3C(F)(F)F)C=C2

Molecular Processing

Molecular formula
C10H11F3N6
Molecular weight
272.23
Exact mass
272.0997
XLogP
0.55
TPSA
58.35
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
60.87

Supplementary Information

InChIKey: XECIZQVFPVPNOD-UHFFFAOYSA-N
مرادفات
338748-56-46-piperazino-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazineMFCD013159471-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperazine6-piperazin-1-yl-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazineSCHEMBL2266118AKOS0050903194M-7646-(piperazin-1-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine6-(piperazin-1-yl)-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazine
عرض المصدر →
مشارك في 265 تفاعل→

بحث موسع

بحث البنية الفرعية→بحث التشابه→