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Home > Imidazoles > 880544-38-7
880544-38-7 | 2H-Benzimidazol-2-one, 1,3-dihydro-1-(phenylmethyl)-4-(1-piperazinyl)-
CAS No: 880544-38-7 Catalog No: AG004LO8 MDL No:
Product Description
Catalog Number:
AG004LO8
Chemical Name:
2H-Benzimidazol-2-one, 1,3-dihydro-1-(phenylmethyl)-4-(1-piperazinyl)-
CAS Number:
880544-38-7
Molecular Formula:
C18H20N4O
Molecular Weight:
308.3776
IUPAC Name:
3-benzyl-7-piperazin-1-yl-1H-benzimidazol-2-one
InChI:
InChI=1S/C18H20N4O/c23-18-20-17-15(21-11-9-19-10-12-21)7-4-8-16(17)22(18)13-14-5-2-1-3-6-14/h1-8,19H,9-13H2,(H,20,23)
InChI Key:
DAYKFJBBBYXISN-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c(n1Cc1ccccc1)cccc2N1CCNCC1
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.164g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
308.385g/mol
Monoisotopic Mass:
308.164g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Serotonin 5-HT6 receptor antagonists for the treatment of cognitive deficiency in Alzheimer's disease. | Journal of medicinal chemistry 20140911 |
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