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Home > Imidazoles > 606111-36-8
606111-36-8 | 1H-Benzimidazole-1-acetamide,2-[[2-(3,4-dihydro-2(1H)-isoquinolinyl)-2-oxoethyl]thio]-N-(1-methylethyl)-(9CI)
CAS No: 606111-36-8 Catalog No: AG00EWB2 MDL No:
Product Description
Catalog Number:
AG00EWB2
Chemical Name:
1H-Benzimidazole-1-acetamide,2-[[2-(3,4-dihydro-2(1H)-isoquinolinyl)-2-oxoethyl]thio]-N-(1-methylethyl)-(9CI)
CAS Number:
606111-36-8
IUPAC Name:
2-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanylbenzimidazol-1-yl]-N-propan-2-ylacetamide
InChI:
InChI=1S/C23H26N4O2S/c1-16(2)24-21(28)14-27-20-10-6-5-9-19(20)25-23(27)30-15-22(29)26-12-11-17-7-3-4-8-18(17)13-26/h3-10,16H,11-15H2,1-2H3,(H,24,28)
InChI Key:
PKDWHFNOHJVSEB-UHFFFAOYSA-N
Properties
Complexity:
616
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
422.178g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
422.547g/mol
Monoisotopic Mass:
422.178g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
92.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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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