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Home > Pyridines > 1197334-04-5
1197334-04-5 | 3,5-Dihydro-5-methyl-N-3-pyridinylbenzo[1,2-b
CAS No: 1197334-04-5 Catalog No: AG01ENQN MDL No:
Product Description
Catalog Number:
AG01ENQN
Chemical Name:
3,5-Dihydro-5-methyl-N-3-pyridinylbenzo[1,2-b
CAS Number:
1197334-04-5
Molecular Formula:
C17H17ClN4O
Molecular Weight:
328.7961
IUPAC Name:
1-methyl-N-pyridin-3-yl-6,7-dihydropyrrolo[2,3-f]indole-5-carboxamide;hydrochloride
InChI:
InChI=1S/C17H16N4O.ClH/c1-20-7-4-12-10-16-13(9-15(12)20)5-8-21(16)17(22)19-14-3-2-6-18-11-14;/h2-4,6-7,9-11H,5,8H2,1H3,(H,19,22);1H
InChI Key:
VGEMBOFBPSNOIO-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c1cc1ccn(c1c2)C)Nc1cccnc1.Cl
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.109g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
328.8g/mol
Monoisotopic Mass:
328.109g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Genetic mapping of targets mediating differential chemical phenotypes in Plasmodium falciparum. | Nature chemical biology 20091001 |
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