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Home > Indoles and Oxindole > 17952-82-8
17952-82-8 | 1H-Pyrido[3,4-b]indol-1-one, 2,3,4,9-tetrahydro-
CAS No: 17952-82-8 Catalog No: AG00272S MDL No:MFCD00065240
Product Description
Catalog Number:
AG00272S
Chemical Name:
1H-Pyrido[3,4-b]indol-1-one, 2,3,4,9-tetrahydro-
CAS Number:
17952-82-8
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD00065240
IUPAC Name:
2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
InChI:
InChI=1S/C11H10N2O/c14-11-10-8(5-6-12-11)7-3-1-2-4-9(7)13-10/h1-4,13H,5-6H2,(H,12,14)
InChI Key:
FZHZQHNKCPJTNQ-UHFFFAOYSA-N
SMILES:
O=C1NCCc2c1[nH]c1c2cccc1
EC Number:
241-878-7
NSC Number:
147829
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:
2
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| β-Carboline alkaloids from the leaves of Trigonostemon lii Y.T. Chang. | Bioorganic & medicinal chemistry letters 20120315 |
| 2-[2-(Methyl-amino)-benzo-yl]-2,3,4,9-tetra-hydro-1H-pyrido[3,4-b]indol-1-one. | Acta crystallographica. Section E, Structure reports online 20100601 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
| New manzamine alkaloids with activity against infectious and tropical parasitic diseases from an Indonesian sponge. | Journal of natural products 20030601 |
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