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Home > Indoles and Oxindole > 211098-45-2
211098-45-2 | 1H-Indole, 1-[(4-methylphenyl)sulfonyl]-5-(phenylmethoxy)-
CAS No: 211098-45-2 Catalog No: AG002L5C MDL No:
Product Description
Catalog Number:
AG002L5C
Chemical Name:
1H-Indole, 1-[(4-methylphenyl)sulfonyl]-5-(phenylmethoxy)-
CAS Number:
211098-45-2
Molecular Formula:
C22H19NO3S
Molecular Weight:
377.4562
IUPAC Name:
1-(4-methylphenyl)sulfonyl-5-phenylmethoxyindole
InChI:
InChI=1S/C22H19NO3S/c1-17-7-10-21(11-8-17)27(24,25)23-14-13-19-15-20(9-12-22(19)23)26-16-18-5-3-2-4-6-18/h2-15H,16H2,1H3
InChI Key:
CNLPZXXUBJXKEJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)n1ccc2c1ccc(c2)OCc1ccccc1
Properties
Complexity:
573
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.109g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
377.458g/mol
Monoisotopic Mass:
377.109g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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