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338415-80-8 | (E)-2-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]ethene-1-sulfonamide
CAS No: 338415-80-8 Catalog No: AG00IXZR MDL No:MFCD01443739
Product Description
Catalog Number:
AG00IXZR
Chemical Name:
(E)-2-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]ethene-1-sulfonamide
CAS Number:
338415-80-8
Molecular Formula:
C16H16ClNO2S
Molecular Weight:
321.8217
MDL Number:
MFCD01443739
IUPAC Name:
2-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]ethenesulfonamide
InChI:
InChI=1S/C16H16ClNO2S/c1-13-2-4-15(5-3-13)12-18-21(19,20)11-10-14-6-8-16(17)9-7-14/h2-11,18H,12H2,1H3
InChI Key:
LNCPWGIIXGFVGY-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CNS(=O)(=O)/C=C/c1ccc(cc1)Cl
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.059g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.819g/mol
Monoisotopic Mass:
321.059g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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