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497059-98-0 | 6-methyl-1-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroquinoline
CAS No: 497059-98-0 Catalog No: AG00IVAO MDL No:MFCD01567399
Product Description
Catalog Number:
AG00IVAO
Chemical Name:
6-methyl-1-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroquinoline
CAS Number:
497059-98-0
Molecular Formula:
C14H15NO2S2
Molecular Weight:
293.4044
MDL Number:
MFCD01567399
IUPAC Name:
6-methyl-1-thiophen-2-ylsulfonyl-3,4-dihydro-2H-quinoline
InChI:
InChI=1S/C14H15NO2S2/c1-11-6-7-13-12(10-11)4-2-8-15(13)19(16,17)14-5-3-9-18-14/h3,5-7,9-10H,2,4,8H2,1H3
InChI Key:
WTYGEMMWJGGXQE-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)CCCN2S(=O)(=O)c1cccs1
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.054g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.399g/mol
Monoisotopic Mass:
293.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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