C1COCCN1CCC2=CC3=C(O2)C=CC(=C3)C4=NC=C(C=C4)C(=O)N5CCOCC5
Nombre: morpholin-4-yl-[6-[2-(2-morpholin-4-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone
SMILES: C1COCCN1CCC2=CC3=C(O2)C=CC(=C3)C4=NC=C(C=C4)C(=O)N5CCOCC5

Molecular Processing

Molecular formula
C24H27N3O4
Molecular weight
421.5
Exact mass
421.2002
XLogP
2.84
TPSA
68.04
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
31
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
117.13

Supplementary Information

InChIKey: YKVQQYCLIBHWNP-UHFFFAOYSA-N
Sinónimos
CHEMBL436237SCHEMBL2785044YKVQQYCLIBHWNP-UHFFFAOYSA-NBDBM501393794-[(6-{2-[2-(4-morpholinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholineMorpholin-4-yl-{6-[2-(2-morpholin-4-yl-ethyl)-benzofuran-5-yl]-pyridin-3-yl}-methanone
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