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606081-94-1 | Piperidine, 4-(2-benzothiazolyl)-1-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]- (9CI)
CAS No: 606081-94-1 Catalog No: AG00F8BO MDL No:
Product Description
Catalog Number:
AG00F8BO
Chemical Name:
Piperidine, 4-(2-benzothiazolyl)-1-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]- (9CI)
CAS Number:
606081-94-1
IUPAC Name:
2-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidin-4-yl]-1,3-benzothiazole
InChI:
InChI=1S/C20H20N2O4S2/c23-28(24,15-5-6-17-18(13-15)26-12-11-25-17)22-9-7-14(8-10-22)20-21-16-3-1-2-4-19(16)27-20/h1-6,13-14H,7-12H2
InChI Key:
GEMOCDSTDIAJGI-UHFFFAOYSA-N
Properties
Complexity:
647
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.086g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
416.51g/mol
Monoisotopic Mass:
416.086g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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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