CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)CNC2CCCC3=C2N=CC=C3)CC4=CC=CC=N4
Название: tert-butyl N-(pyridin-2-ylmethyl)-N-[[4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]phenyl]methyl]carbamate
SMILES: CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)CNC2CCCC3=C2N=CC=C3)CC4=CC=CC=N4

Molecular Processing

Molecular formula
C28H34N4O2
Molecular weight
458.61
Exact mass
458.2682
XLogP
5.58
TPSA
67.35
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
34
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
0.393
Molar refractivity
132.92

Supplementary Information

InChIKey: OCUGCLNLHXZMCD-UHFFFAOYSA-N
Синонимы
SCHEMBL3312245OCUGCLNLHXZMCD-UHFFFAOYSA-NN-(t-butoxycarbonyl)-N-(2-pyridinylmethyl)-N'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamineN-(t-butyloxycarbonyl)-N-(2-pyridinylmethyl)-N'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamineN-(tert-butoxycarbonyl)-N-(2-pyridinylmethyl)-N'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanaminen-(tert-butyloxycarbonyl)-n-(2-pyridinylmethyl)-n'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamine
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