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117138-75-7 | 1H-Benz[g]indole-2,3-dione, 4,5-dihydro-1-(methylphenylamino)-
CAS No: 117138-75-7 Catalog No: AG000DSW MDL No:
Product Description
Catalog Number:
AG000DSW
Chemical Name:
1H-Benz[g]indole-2,3-dione, 4,5-dihydro-1-(methylphenylamino)-
CAS Number:
117138-75-7
Molecular Formula:
C19H16N2O2
Molecular Weight:
304.3425
IUPAC Name:
1-(N-methylanilino)-4,5-dihydrobenzo[g]indole-2,3-dione
InChI:
InChI=1S/C19H16N2O2/c1-20(14-8-3-2-4-9-14)21-17-15-10-6-5-7-13(15)11-12-16(17)18(22)19(21)23/h2-10H,11-12H2,1H3
InChI Key:
DBGGQAUBIWRBHP-UHFFFAOYSA-N
SMILES:
O=C1C2=C(N(C1=O)N(c1ccccc1)C)c1c(CC2)cccc1
Properties
Complexity:
548
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.121g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.349g/mol
Monoisotopic Mass:
304.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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