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865659-20-7 | 4-methoxy-N-{pyrrolo[1,2-a]quinolin-6-yl}benzene-1-sulfonamide
CAS No: 865659-20-7 Catalog No: AG00IPSD MDL No:MFCD03848499
Product Description
Catalog Number:
AG00IPSD
Chemical Name:
4-methoxy-N-{pyrrolo[1,2-a]quinolin-6-yl}benzene-1-sulfonamide
CAS Number:
865659-20-7
Molecular Formula:
C19H16N2O3S
Molecular Weight:
352.4069
MDL Number:
MFCD03848499
IUPAC Name:
4-methoxy-N-pyrrolo[1,2-a]quinolin-6-ylbenzenesulfonamide
InChI:
InChI=1S/C19H16N2O3S/c1-24-15-8-10-16(11-9-15)25(22,23)20-18-5-2-6-19-17(18)12-7-14-4-3-13-21(14)19/h2-13,20H,1H3
InChI Key:
JNNISYCJILXBNI-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1ccc1n2ccc1
Properties
Complexity:
554
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.088g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
352.408g/mol
Monoisotopic Mass:
352.088g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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