Name: 6-benzyl-1,7-dimethyl-N-piperidin-4-yl-6H-pyrrolo[2,3-e][1,2,4]triazolo[4,3-a]pyridin-4-amine
SMILES:
Cc1cc2c(cc(NC3CCNCC3)c3nnc(C)n32)n1Cc1ccccc1Molecular Processing
Molecular formula
C22H26N6
Molecular weight
374.49
Exact mass
374.2219
XLogP
3.51
TPSA
59.18
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
28
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
113.02
Supplementary Information
Details werden geladen…
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