CCC1=NC2=CC=CC=C2N1C3=NC4=C(C(=N3)N5CCOCC5)N=C(N4C)C=O
الاسم: 2-(2-ethylbenzimidazol-1-yl)-9-methyl-6-morpholin-4-ylpurine-8-carbaldehyde
SMILES: CCC1=NC2=CC=CC=C2N1C3=NC4=C(C(=N3)N5CCOCC5)N=C(N4C)C=O

Molecular Processing

Molecular formula
C20H21N7O2
Molecular weight
391.44
Exact mass
391.1757
XLogP
1.91
TPSA
90.96
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
29
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
108.73

Supplementary Information

InChIKey: YHWAYFOXXNERNV-UHFFFAOYSA-N
مرادفات
SCHEMBL2674412YHWAYFOXXNERNV-UHFFFAOYSA-N2-(2-ethyl-1H-benzo[d]imidazol-1-yl)-9-methyl-6-morpholino-9H-purine-8-carbaldehyde2-(2-Ethylbenzoimidazol-1-yl)-9-methyl-6-morpholin-4-yl-9H-purine-8-carbaldehyde
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