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Home > Quinoline > 872107-96-5
872107-96-5 | 6-(piperidine-1-sulfonyl)-1,2,3,4-tetrahydroquinoline
CAS No: 872107-96-5 Catalog No: AG019OTQ MDL No:MFCD07686061
Product Description
Catalog Number:
AG019OTQ
Chemical Name:
6-(piperidine-1-sulfonyl)-1,2,3,4-tetrahydroquinoline
CAS Number:
872107-96-5
Molecular Formula:
C14H20N2O2S
Molecular Weight:
280.3858
MDL Number:
MFCD07686061
IUPAC Name:
6-piperidin-1-ylsulfonyl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C14H20N2O2S/c17-19(18,16-9-2-1-3-10-16)13-6-7-14-12(11-13)5-4-8-15-14/h6-7,11,15H,1-5,8-10H2
InChI Key:
RDBWFNFOFIXMOK-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccc2c(c1)CCCN2)N1CCCCC1
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.125g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.386g/mol
Monoisotopic Mass:
280.125g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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