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478032-19-8 | (E)-N-[(4-methylphenyl)methyl]-2-[4-(propan-2-yl)phenyl]ethene-1-sulfonamide
CAS No: 478032-19-8 Catalog No: AG00IOPK MDL No:MFCD01815107
Product Description
Catalog Number:
AG00IOPK
Chemical Name:
(E)-N-[(4-methylphenyl)methyl]-2-[4-(propan-2-yl)phenyl]ethene-1-sulfonamide
CAS Number:
478032-19-8
Molecular Formula:
C19H23NO2S
Molecular Weight:
329.4564
MDL Number:
MFCD01815107
IUPAC Name:
N-[(4-methylphenyl)methyl]-2-(4-propan-2-ylphenyl)ethenesulfonamide
InChI:
InChI=1S/C19H23NO2S/c1-15(2)19-10-8-17(9-11-19)12-13-23(21,22)20-14-18-6-4-16(3)5-7-18/h4-13,15,20H,14H2,1-3H3
InChI Key:
YYZCWFORUDAGRE-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CNS(=O)(=O)/C=C/c1ccc(cc1)C(C)C
Properties
Complexity:
462
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.145g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.458g/mol
Monoisotopic Mass:
329.145g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.3
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