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Home > Indoles and Oxindole > 651331-73-6
651331-73-6 | 1H-Indole-3-tetradecanol, 5-methoxy-1-[(4-methoxyphenyl)sulfonyl]-
CAS No: 651331-73-6 Catalog No: AG006QJV MDL No:
Product Description
Catalog Number:
AG006QJV
Chemical Name:
1H-Indole-3-tetradecanol, 5-methoxy-1-[(4-methoxyphenyl)sulfonyl]-
CAS Number:
651331-73-6
Molecular Formula:
C30H43NO5S
Molecular Weight:
529.7311
IUPAC Name:
14-[5-methoxy-1-(4-methoxyphenyl)sulfonylindol-3-yl]tetradecan-1-ol
InChI:
InChI=1S/C30H43NO5S/c1-35-26-16-19-28(20-17-26)37(33,34)31-24-25(29-23-27(36-2)18-21-30(29)31)15-13-11-9-7-5-3-4-6-8-10-12-14-22-32/h16-21,23-24,32H,3-15,22H2,1-2H3
InChI Key:
IMLWRMJLACYNSG-UHFFFAOYSA-N
SMILES:
OCCCCCCCCCCCCCCc1cn(c2c1cc(OC)cc2)S(=O)(=O)c1ccc(cc1)OC
Properties
Complexity:
703
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
529.286g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
529.736g/mol
Monoisotopic Mass:
529.286g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
86.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.9
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