C1CNCC2=C1N=CN=C2NC3=CC=C(C=C3)C(F)(F)F
名称: N-[4-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine
SMILES: C1CNCC2=C1N=CN=C2NC3=CC=C(C=C3)C(F)(F)F

Molecular Processing

Molecular formula
C14H13F3N4
Molecular weight
294.28
Exact mass
294.1092
XLogP
2.88
TPSA
49.84
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
72.17

Supplementary Information

InChIKey: UQEHNIONZWRCCR-UHFFFAOYSA-N
同義語
(5,6,7,8-Tetrahydro-pyrido[4,3-d]pyrimidin-4-yl)-(4-trifluoromethylphenyl)amineSCHEMBL2846226N-(4-(Trifluoromethyl)phenyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine
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