CCCCC1=NC2=C(N1CCCCNC(=O)C3=CC=C(C=C3)C(C4=CC=CC=C4)OCCN(C)C)C(=C(N=C2OC5=CC=CC=C5)C)C
الاسم: N-[4-(2-butyl-6,7-dimethyl-4-phenoxyimidazo[4,5-c]pyridin-1-yl)butyl]-4-[2-(dimethylamino)ethoxy-phenylmethyl]benzamide
SMILES: CCCCC1=NC2=C(N1CCCCNC(=O)C3=CC=C(C=C3)C(C4=CC=CC=C4)OCCN(C)C)C(=C(N=C2OC5=CC=CC=C5)C)C

Molecular Processing

Molecular formula
C40H49N5O3
Molecular weight
647.86
Exact mass
647.3835
XLogP
8.06
TPSA
81.51
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
17
Heavy atoms
48
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
192.93

Supplementary Information

InChIKey: SRQSOKANDTVRNP-UHFFFAOYSA-N
مرادفات
SCHEMBL6095413SRQSOKANDTVRNP-UHFFFAOYSA-NN-[4-(2-butyl-6,7-dimethyl-4-phenoxy-1H-imidazo[4,5-c]pyridin-1-yl)butyl]-4-[[2-(dimethylamino)ethoxy](phenyl)methyl]benzamideN-[4-(2-butyl-6,7-dimethyl-4-phenoxy-1H-imidazo[4,5-c]pyridin-1-yl)butyl]4-[[2-(dimethylamino)ethoxy](phenyl)methyl]benzamide
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