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Home > Pyridines > 114149-44-9
114149-44-9 | Benzenesulfonamide, N-[2,3-dihydro-5-(1,4,5,6-tetrahydro-4-methyl-6-oxo-3-pyridazinyl)-1H-inden-2-yl]-
CAS No: 114149-44-9 Catalog No: AG000AOG MDL No:
Product Description
Catalog Number:
AG000AOG
Chemical Name:
Benzenesulfonamide, N-[2,3-dihydro-5-(1,4,5,6-tetrahydro-4-methyl-6-oxo-3-pyridazinyl)-1H-inden-2-yl]-
CAS Number:
114149-44-9
Molecular Formula:
C20H21N3O3S
Molecular Weight:
383.4640
IUPAC Name:
N-[5-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide
InChI:
InChI=1S/C20H21N3O3S/c1-13-9-19(24)21-22-20(13)15-8-7-14-11-17(12-16(14)10-15)23-27(25,26)18-5-3-2-4-6-18/h2-8,10,13,17,23H,9,11-12H2,1H3,(H,21,24)
InChI Key:
CBDKKURJIOWUAX-UHFFFAOYSA-N
SMILES:
O=C1NN=C(C(C1)C)c1ccc2c(c1)CC(C2)NS(=O)(=O)c1ccccc1
Properties
Complexity:
694
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
383.13g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
383.466g/mol
Monoisotopic Mass:
383.13g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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