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37481-42-8 | Isoquinoline, 1,2,3,4-tetrahydro-5-(2,6-diethylbenzamido)-2-methyl-
CAS No: 37481-42-8 Catalog No: AG00CZ2W MDL No:
Product Description
Catalog Number:
AG00CZ2W
Chemical Name:
Isoquinoline, 1,2,3,4-tetrahydro-5-(2,6-diethylbenzamido)-2-methyl-
CAS Number:
37481-42-8
IUPAC Name:
2,6-diethyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)benzamide
InChI:
InChI=1S/C21H26N2O/c1-4-15-8-6-9-16(5-2)20(15)21(24)22-19-11-7-10-17-14-23(3)13-12-18(17)19/h6-11H,4-5,12-14H2,1-3H3,(H,22,24)
InChI Key:
YBAXILSHGYLEHM-UHFFFAOYSA-N
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.205g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
322.452g/mol
Monoisotopic Mass:
322.205g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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