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24310-39-2 | 4(1H)-Quinolinone,2,3-dihydro-6-methoxy-2-methyl-1-[(4-methylphenyl)sulfonyl]-
CAS No: 24310-39-2 Catalog No: AG007NT8 MDL No:
Product Description
Catalog Number:
AG007NT8
Chemical Name:
4(1H)-Quinolinone,2,3-dihydro-6-methoxy-2-methyl-1-[(4-methylphenyl)sulfonyl]-
CAS Number:
24310-39-2
Molecular Formula:
C18H19NO4S
Molecular Weight:
345.4128
IUPAC Name:
6-methoxy-2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydroquinolin-4-one
InChI:
InChI=1S/C18H19NO4S/c1-12-4-7-15(8-5-12)24(21,22)19-13(2)10-18(20)16-11-14(23-3)6-9-17(16)19/h4-9,11,13H,10H2,1-3H3
InChI Key:
CABMEFDWUZFZOG-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)C(=O)CC(N2S(=O)(=O)c1ccc(cc1)C)C
NSC Number:
124431
Properties
Complexity:
562
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.103g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
345.413g/mol
Monoisotopic Mass:
345.103g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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