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873208-54-9 | 6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinoline
CAS No: 873208-54-9 Catalog No: AG019P69 MDL No:MFCD07687256
Product Description
Catalog Number:
AG019P69
Chemical Name:
6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinoline
CAS Number:
873208-54-9
Molecular Formula:
C13H18N2O2S
Molecular Weight:
266.3592
MDL Number:
MFCD07687256
IUPAC Name:
6-pyrrolidin-1-ylsulfonyl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C13H18N2O2S/c16-18(17,15-8-1-2-9-15)12-5-6-13-11(10-12)4-3-7-14-13/h5-6,10,14H,1-4,7-9H2
InChI Key:
CVGAVEBLFIEIQO-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccc2c(c1)CCCN2)N1CCCC1
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.109g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.359g/mol
Monoisotopic Mass:
266.109g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| 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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