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Home > Quinoline > 913534-05-1
913534-05-1 | N-Cyclohexyl-7-chloro-1-[2-(4-morpholinyl)ethyl]quinolin-4(1H)-one-3-carboxamide
CAS No: 913534-05-1 Catalog No: AG00H0AF MDL No:
Product Description
Catalog Number:
AG00H0AF
Chemical Name:
N-Cyclohexyl-7-chloro-1-[2-(4-morpholinyl)ethyl]quinolin-4(1H)-one-3-carboxamide
CAS Number:
913534-05-1
Molecular Formula:
C22H28ClN3O3
Molecular Weight:
417.9290
IUPAC Name:
7-chloro-N-cyclohexyl-1-(2-morpholin-4-ylethyl)-4-oxoquinoline-3-carboxamide
InChI:
InChI=1S/C22H28ClN3O3/c23-16-6-7-18-20(14-16)26(9-8-25-10-12-29-13-11-25)15-19(21(18)27)22(28)24-17-4-2-1-3-5-17/h6-7,14-15,17H,1-5,8-13H2,(H,24,28)
InChI Key:
MFKWLGOHFQBVAA-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)n(CCN1CCOCC1)cc(c2=O)C(=O)NC1CCCCC1
Properties
Complexity:
629
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
417.182g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
417.934g/mol
Monoisotopic Mass:
417.182g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| Design, synthesis, and biological evaluation of new 1,8-naphthyridin-4(1H)-on-3-carboxamide and quinolin-4(1H)-on-3-carboxamide derivatives as CB2 selective agonists. | Journal of medicinal chemistry 20061005 |
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