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Home > Imidazoles > 820964-17-8
820964-17-8 | 1H-Imidazo[1,5-a]indole-1,3(2H)-dione, 2-(4-methylphenyl)-
CAS No: 820964-17-8 Catalog No: AG008K1E MDL No:
Product Description
Catalog Number:
AG008K1E
Chemical Name:
1H-Imidazo[1,5-a]indole-1,3(2H)-dione, 2-(4-methylphenyl)-
CAS Number:
820964-17-8
Molecular Formula:
C17H12N2O2
Molecular Weight:
276.2894
IUPAC Name:
2-(4-methylphenyl)imidazo[1,5-a]indole-1,3-dione
InChI:
InChI=1S/C17H12N2O2/c1-11-6-8-13(9-7-11)18-16(20)15-10-12-4-2-3-5-14(12)19(15)17(18)21/h2-10H,1H3
InChI Key:
MKZVHOZVPKOBQU-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)n1c(=O)c2n(c1=O)c1c(c2)cccc1
Properties
Complexity:
456
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.09g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.295g/mol
Monoisotopic Mass:
276.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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