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Home > Other Heterocycles > 137419-02-4
137419-02-4 | Spiro[1H-indene-1,4'-piperidine], 1'-[(4-methoxyphenyl)sulfonyl]-
CAS No: 137419-02-4 Catalog No: AG00139C MDL No:
Product Description
Catalog Number:
AG00139C
Chemical Name:
Spiro[1H-indene-1,4'-piperidine], 1'-[(4-methoxyphenyl)sulfonyl]-
CAS Number:
137419-02-4
Molecular Formula:
C20H21NO3S
Molecular Weight:
355.4506
IUPAC Name:
1'-(4-methoxyphenyl)sulfonylspiro[indene-1,4'-piperidine]
InChI:
InChI=1S/C20H21NO3S/c1-24-17-6-8-18(9-7-17)25(22,23)21-14-12-20(13-15-21)11-10-16-4-2-3-5-19(16)20/h2-11H,12-15H2,1H3
InChI Key:
JPOGVRJMRKHDAG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)S(=O)(=O)N1CCC2(CC1)C=Cc1c2cccc1
Properties
Complexity:
593
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.124g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
355.452g/mol
Monoisotopic Mass:
355.124g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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