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1790895-25-8

1790895-25-8 | N-​(2,​3-Dihydro-​1,​4-​benzodioxin-​6-​yl)​-​1,​2-​dihydro-​1-​methyl-​2-​oxo-4-​quinolinecarboxamide​

CAS No: 1790895-25-8 Catalog No: AG01E2UF MDL No:

Product Description

Catalog Number:
AG01E2UF
Chemical Name:
N-​(2,​3-Dihydro-​1,​4-​benzodioxin-​6-​yl)​-​1,​2-​dihydro-​1-​methyl-​2-​oxo-4-​quinolinecarboxamide​
CAS Number:
1790895-25-8
Molecular Formula:
C19H16N2O4
Molecular Weight:
336.3413
IUPAC Name:
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-2-oxoquinoline-4-carboxamide
InChI:
InChI=1S/C19H16N2O4/c1-21-15-5-3-2-4-13(15)14(11-18(21)22)19(23)20-12-6-7-16-17(10-12)25-9-8-24-16/h2-7,10-11H,8-9H2,1H3,(H,20,23)
InChI Key:
NXKBPGZQDHACPZ-UHFFFAOYSA-N
SMILES:
O=C(c1cc(=O)n(c2c1cccc2)C)Nc1ccc2c(c1)OCCO2

Properties

Complexity:
576  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.111g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
336.347g/mol
Monoisotopic Mass:
336.111g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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