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88041-12-7 | Methanesulfonamide, N-[5-phenoxy-3-(propylamino)-1H-inden-6-yl]-
CAS No: 88041-12-7 Catalog No: AG004J4Z MDL No:
Product Description
Catalog Number:
AG004J4Z
Chemical Name:
Methanesulfonamide, N-[5-phenoxy-3-(propylamino)-1H-inden-6-yl]-
CAS Number:
88041-12-7
Molecular Formula:
C19H22N2O3S
Molecular Weight:
358.4546
IUPAC Name:
N-[6-phenoxy-1-(propylamino)-3H-inden-5-yl]methanesulfonamide
InChI:
InChI=1S/C19H22N2O3S/c1-3-11-20-17-10-9-14-12-18(21-25(2,22)23)19(13-16(14)17)24-15-7-5-4-6-8-15/h4-8,10,12-13,20-21H,3,9,11H2,1-2H3
InChI Key:
KWUPONPBIYQVKU-UHFFFAOYSA-N
SMILES:
CCCNC1=CCc2c1cc(Oc1ccccc1)c(c2)NS(=O)(=O)C
Properties
Complexity:
564
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.135g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
358.456g/mol
Monoisotopic Mass:
358.135g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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