200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 114149-38-1
114149-38-1 | Benzenesulfonamide, N-[2,3-dihydro-5-(1,4,5,6-tetrahydro-6-oxo-3-pyridazinyl)-1H-inden-2-yl]-4-methyl-
CAS No: 114149-38-1 Catalog No: AG000AOI MDL No:
Product Description
Catalog Number:
AG000AOI
Chemical Name:
Benzenesulfonamide, N-[2,3-dihydro-5-(1,4,5,6-tetrahydro-6-oxo-3-pyridazinyl)-1H-inden-2-yl]-4-methyl-
CAS Number:
114149-38-1
Molecular Formula:
C20H21N3O3S
Molecular Weight:
383.4640
IUPAC Name:
4-methyl-N-[5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide
InChI:
InChI=1S/C20H21N3O3S/c1-13-2-6-18(7-3-13)27(25,26)23-17-11-14-4-5-15(10-16(14)12-17)19-8-9-20(24)22-21-19/h2-7,10,17,23H,8-9,11-12H2,1H3,(H,22,24)
InChI Key:
HPHBEFJDQBZDEF-UHFFFAOYSA-N
SMILES:
O=C1CCC(=NN1)c1ccc2c(c1)CC(C2)NS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
692
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.