C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F)CCCC#N
الاسم: 4-[4-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]butanenitrile
SMILES: C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F)CCCC#N

Molecular Processing

Molecular formula
C23H26FN5
Molecular weight
391.49
Exact mass
391.2172
XLogP
4.4
TPSA
56.88
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.391
Molar refractivity
113.17

Supplementary Information

InChIKey: AQFLYRCSNBNSMQ-UHFFFAOYSA-N
مرادفات
SCHEMBL9742219AQFLYRCSNBNSMQ-UHFFFAOYSA-N4-[[1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-yl]-amino]-1-piperidinebutanenitrile4-[[1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-yl]amino]-1-piperidinebutanenitrile
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