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606081-93-0 | Piperidine, 4-(1H-benzimidazol-2-yl)-1-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]- (9CI)
CAS No: 606081-93-0 Catalog No: AG00F8BN MDL No:
Product Description
Catalog Number:
AG00F8BN
Chemical Name:
Piperidine, 4-(1H-benzimidazol-2-yl)-1-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]- (9CI)
CAS Number:
606081-93-0
IUPAC Name:
2-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidin-4-yl]-1H-benzimidazole
InChI:
InChI=1S/C20H21N3O4S/c24-28(25,15-5-6-18-19(13-15)27-12-11-26-18)23-9-7-14(8-10-23)20-21-16-3-1-2-4-17(16)22-20/h1-6,13-14H,7-12H2,(H,21,22)
InChI Key:
BIZJQOGZDCRMRY-UHFFFAOYSA-N
Properties
Complexity:
646
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.125g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
399.465g/mol
Monoisotopic Mass:
399.125g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Assay principle for modulators of protein-protein interactions and its application to non-ATP-competitive ligands targeting protein kinase A. | Analytical chemistry 20061215 |
| 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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