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604778-70-3 | Pyrazinecarboxamide, N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]- (9CI)
CAS No: 604778-70-3 Catalog No: AG00F82P MDL No:
Product Description
Catalog Number:
AG00F82P
Chemical Name:
Pyrazinecarboxamide, N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]- (9CI)
CAS Number:
604778-70-3
IUPAC Name:
N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]pyrazine-2-carboxamide
InChI:
InChI=1S/C22H23N7O/c1-15-7-8-16-12-17(21-25-26-27-29(21)20(16)11-15)14-28(18-5-3-2-4-6-18)22(30)19-13-23-9-10-24-19/h7-13,18H,2-6,14H2,1H3
InChI Key:
UMYAEPOGFDFHCK-UHFFFAOYSA-N
Properties
Complexity:
598
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
401.196g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
401.474g/mol
Monoisotopic Mass:
401.196g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
89.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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