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604780-22-5 | Pyrazinecarboxamide, N-[(2-chloro-8-methyl-3-quinolinyl)methyl]-N-cyclohexyl- (9CI)
CAS No: 604780-22-5 Catalog No: AG00EHZS MDL No:
Product Description
Catalog Number:
AG00EHZS
Chemical Name:
Pyrazinecarboxamide, N-[(2-chloro-8-methyl-3-quinolinyl)methyl]-N-cyclohexyl- (9CI)
CAS Number:
604780-22-5
IUPAC Name:
N-[(2-chloro-8-methylquinolin-3-yl)methyl]-N-cyclohexylpyrazine-2-carboxamide
InChI:
InChI=1S/C22H23ClN4O/c1-15-6-5-7-16-12-17(21(23)26-20(15)16)14-27(18-8-3-2-4-9-18)22(28)19-13-24-10-11-25-19/h5-7,10-13,18H,2-4,8-9,14H2,1H3
InChI Key:
YBIKBCQYUYQEOX-UHFFFAOYSA-N
Properties
Complexity:
527
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
394.156g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
394.903g/mol
Monoisotopic Mass:
394.156g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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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