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380341-47-9 | N,N,1-triethyl-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide
CAS No: 380341-47-9 Catalog No: AG019HM2 MDL No:MFCD02725137
Product Description
Catalog Number:
AG019HM2
Chemical Name:
N,N,1-triethyl-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide
CAS Number:
380341-47-9
Molecular Formula:
C14H21N3O3S
Molecular Weight:
311.3998
MDL Number:
MFCD02725137
IUPAC Name:
N,N,1-triethyl-3-oxo-2,4-dihydroquinoxaline-6-sulfonamide
InChI:
InChI=1S/C14H21N3O3S/c1-4-16-10-14(18)15-12-9-11(7-8-13(12)16)21(19,20)17(5-2)6-3/h7-9H,4-6,10H2,1-3H3,(H,15,18)
InChI Key:
WKZPJIIXBPWJCY-UHFFFAOYSA-N
SMILES:
CCN1CC(=O)Nc2c1ccc(c2)S(=O)(=O)N(CC)CC
Properties
Complexity:
470
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.13g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
311.4g/mol
Monoisotopic Mass:
311.13g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
78.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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