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1803566-35-9

1803566-35-9 | N-[1-(1,3-dimethyl-1H-pyrazol-5-yl)-2-oxopiperidin-3-yl]methanesulfonamide

CAS No: 1803566-35-9 Catalog No: AG01AGCL MDL No:MFCD28023694

Product Description

Catalog Number:
AG01AGCL
Chemical Name:
N-[1-(1,3-dimethyl-1H-pyrazol-5-yl)-2-oxopiperidin-3-yl]methanesulfonamide
CAS Number:
1803566-35-9
Molecular Formula:
C11H18N4O3S
Molecular Weight:
286.3506
MDL Number:
MFCD28023694
IUPAC Name:
N-[1-(2,5-dimethylpyrazol-3-yl)-2-oxopiperidin-3-yl]methanesulfonamide
InChI:
InChI=1S/C11H18N4O3S/c1-8-7-10(14(2)12-8)15-6-4-5-9(11(15)16)13-19(3,17)18/h7,9,13H,4-6H2,1-3H3
InChI Key:
YFGIJLTVPADXMI-UHFFFAOYSA-N
SMILES:
O=C1C(CCCN1c1cc(nn1C)C)NS(=O)(=O)C

Properties

Complexity:
447  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.11g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
286.35g/mol
Monoisotopic Mass:
286.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0

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