CC(C)(C)OC(=O)N1C2=CC=CC=C2N=C1CNC3CCCC4=C3N=CC=C4
Nombre: tert-butyl 2-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzimidazole-1-carboxylate
SMILES: CC(C)(C)OC(=O)N1C2=CC=CC=C2N=C1CNC3CCCC4=C3N=CC=C4

Molecular Processing

Molecular formula
C22H26N4O2
Molecular weight
378.48
Exact mass
378.2056
XLogP
4.38
TPSA
69.04
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
108.12

Supplementary Information

InChIKey: DNTCKJDFHQADBP-UHFFFAOYSA-N
Sinónimos
SCHEMBL3373812DNTCKJDFHQADBP-UHFFFAOYSA-N(1-tert-butoxycarbonyl-benzimidazol-2-ylmethyl)-(5,6,7,8-tetrahydroquinolin-8-yl)-amine(1-tert-butoxycarbonyl-1H-Benzimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl) -amine(1-tert-butoxycarbonyl-1H-Benzimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amine[1-(tert-butoxycarbonyl)-(1H-benzimidazol-2-ylmethyl)]-(5,6,7,8-tetrahydro-quinolin-8-yl)-amine2-[(5,6,7,8-tetrahydro-quinolin-8-ylamino)-methyl]-benzoimidazole-1-carboxylic acid tert-butyl ester2-[(5,6,7,8-tetrahydroquinolin-8-ylamino)-methyl]-benzimidazole-1-carboxylic acid tert-butyl ester
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