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Home > Indoles and Oxindole > 152193-85-6
152193-85-6 | 3,4-Dihydropyrazino[1,2-a]indol-1(2H)-one
CAS No: 152193-85-6 Catalog No: AG006UBZ MDL No:MFCD08272112
Product Description
Catalog Number:
AG006UBZ
Chemical Name:
3,4-Dihydropyrazino[1,2-a]indol-1(2H)-one
CAS Number:
152193-85-6
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD08272112
IUPAC Name:
3,4-dihydro-2H-pyrazino[1,2-a]indol-1-one
InChI:
InChI=1S/C11H10N2O/c14-11-10-7-8-3-1-2-4-9(8)13(10)6-5-12-11/h1-4,7H,5-6H2,(H,12,14)
InChI Key:
KRRWBFJXTNMYOZ-UHFFFAOYSA-N
SMILES:
O=C1NCCn2c1cc1c2cccc1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Discovery of potent and selective histamine H3 receptor inverse agonists based on the 3,4-dihydro-2H-pyrazino[1,2-a]indol-1-one scaffold. | Bioorganic & medicinal chemistry letters 20101001 |
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