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113850-24-1 | 1-Naphthalenesulfonamide, N-(2,3-dihydroxypropyl)-5-(dimethylamino)-
CAS No: 113850-24-1 Catalog No: AG0009X0 MDL No:
Product Description
Catalog Number:
AG0009X0
Chemical Name:
1-Naphthalenesulfonamide, N-(2,3-dihydroxypropyl)-5-(dimethylamino)-
CAS Number:
113850-24-1
Molecular Formula:
C15H20N2O4S
Molecular Weight:
324.3953
IUPAC Name:
N-(2,3-dihydroxypropyl)-5-(dimethylamino)naphthalene-1-sulfonamide
InChI:
InChI=1S/C15H20N2O4S/c1-17(2)14-7-3-6-13-12(14)5-4-8-15(13)22(20,21)16-9-11(19)10-18/h3-8,11,16,18-19H,9-10H2,1-2H3
InChI Key:
YRLLRSOCHXQZOU-UHFFFAOYSA-N
SMILES:
OCC(CNS(=O)(=O)c1cccc2c1cccc2N(C)C)O
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.114g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
324.395g/mol
Monoisotopic Mass:
324.114g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
98.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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