C1CC(C2=C(C1)C=CC=N2)N(CC3=CC=C(C=C3)CN)CC4=NC5=CC=CC=C5N4
Nom: N-[[4-(aminomethyl)phenyl]methyl]-N-(1H-benzimidazol-2-ylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
SMILES: C1CC(C2=C(C1)C=CC=N2)N(CC3=CC=C(C=C3)CN)CC4=NC5=CC=CC=C5N4

Molecular Processing

Molecular formula
C25H27N5
Molecular weight
397.53
Exact mass
397.2266
XLogP
4.5
TPSA
70.83
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
30
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
119.59

Supplementary Information

InChIKey: WOHISNQXTSCFOC-UHFFFAOYSA-N
Synonymes
CHEMBL1092324N-[(1H-Benzo[d]imidazol-2-yl)methyl]-N-(4-(aminomethyl)-benzyl)-5,6,7,8-tetrahydroquinolin-8-amineSCHEMBL3378111WOHISNQXTSCFOC-UHFFFAOYSA-NBDBM50315288(4-aminomethyl-benzyl)-(1H-benzimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amine(4-aminomethyl-benzyl)-(1h-benzoimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amineN'-(1H-benzimidazol-2-ylmethyl)-N'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamineN'-(1H-benzirnidazol-2-ylmethyl)-N'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamineN-(1H-benzimidazol-2-ylmethyl)-N-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamineN-[[4-(aminomethyl)phenyl]methyl]-N-(1H-benzimidazol-2-ylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
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Recherche Etendue

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