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604780-72-5 | Pyrazinecarboxamide, N-[(2-chloro-6-methyl-3-quinolinyl)methyl]-N-cyclopentyl- (9CI)
CAS No: 604780-72-5 Catalog No: AG00F82V MDL No:
Product Description
Catalog Number:
AG00F82V
Chemical Name:
Pyrazinecarboxamide, N-[(2-chloro-6-methyl-3-quinolinyl)methyl]-N-cyclopentyl- (9CI)
CAS Number:
604780-72-5
IUPAC Name:
N-[(2-chloro-6-methylquinolin-3-yl)methyl]-N-cyclopentylpyrazine-2-carboxamide
InChI:
InChI=1S/C21H21ClN4O/c1-14-6-7-18-15(10-14)11-16(20(22)25-18)13-26(17-4-2-3-5-17)21(27)19-12-23-8-9-24-19/h6-12,17H,2-5,13H2,1H3
InChI Key:
ZXHWYNVUPXXFLB-UHFFFAOYSA-N
Properties
Complexity:
512
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.14g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
380.876g/mol
Monoisotopic Mass:
380.14g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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