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Home > Other Heterocycles > 144365-79-7
144365-79-7 | 2-Propanone, 1-[3-[(4-methylphenyl)sulfonyl]-3-azabicyclo[3.1.0]hex-1-yl]-
CAS No: 144365-79-7 Catalog No: AG001JEB MDL No:
Product Description
Catalog Number:
AG001JEB
Chemical Name:
2-Propanone, 1-[3-[(4-methylphenyl)sulfonyl]-3-azabicyclo[3.1.0]hex-1-yl]-
CAS Number:
144365-79-7
Molecular Formula:
C15H19NO3S
Molecular Weight:
293.3813
IUPAC Name:
1-[3-(4-methylphenyl)sulfonyl-3-azabicyclo[3.1.0]hexan-1-yl]propan-2-one
InChI:
InChI=1S/C15H19NO3S/c1-11-3-5-14(6-4-11)20(18,19)16-9-13-8-15(13,10-16)7-12(2)17/h3-6,13H,7-10H2,1-2H3
InChI Key:
UPCSKHBOFXLDDL-UHFFFAOYSA-N
SMILES:
CC(=O)CC12CC2CN(C1)S(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
502
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.109g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.381g/mol
Monoisotopic Mass:
293.109g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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