Nom: 1-(3H-benzimidazol-5-yl)-3-hydroxy-2-(4-morpholin-4-ylphenyl)-2H-pyrrol-5-one
SMILES:
C1COCCN1C2=CC=C(C=C2)C3C(=CC(=O)N3C4=CC5=C(C=C4)N=CN5)OMolecular Processing
Molecular formula
C21H20N4O3
Molecular weight
376.42
Exact mass
376.1535
XLogP
2.93
TPSA
81.69
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
28
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
106.51
Supplementary Information
InChIKey: DDODCIYWALAATM-UHFFFAOYSA-N
Synonymes
SCHEMBL12274785DDODCIYWALAATM-UHFFFAOYSA-N1-(1H-benzo[d]imidazol-5-yl)-4-hydroxy-5-(4-morpholinophenyl)-1H-pyrrol-2(5H)-one
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