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247582-63-4 | Piperazine, 1-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-4-ethyl-
CAS No: 247582-63-4 Catalog No: AG002PCM MDL No:
Product Description
Catalog Number:
AG002PCM
Chemical Name:
Piperazine, 1-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-4-ethyl-
CAS Number:
247582-63-4
Molecular Formula:
C11H15BrClN3O2S
Molecular Weight:
368.6777
IUPAC Name:
1-(5-bromo-6-chloropyridin-3-yl)sulfonyl-4-ethylpiperazine
InChI:
InChI=1S/C11H15BrClN3O2S/c1-2-15-3-5-16(6-4-15)19(17,18)9-7-10(12)11(13)14-8-9/h7-8H,2-6H2,1H3
InChI Key:
XWPYRBXBZULFKE-UHFFFAOYSA-N
SMILES:
CCN1CCN(CC1)S(=O)(=O)c1cnc(c(c1)Br)Cl
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.976g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.674g/mol
Monoisotopic Mass:
366.976g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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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