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Home > Quinoline > 836611-98-4
836611-98-4 | 5-Quinolinecarboxamide, 6-chloro-2-methyl-N-(2-phenylethyl)-
CAS No: 836611-98-4 Catalog No: AG008IM7 MDL No:
Product Description
Catalog Number:
AG008IM7
Chemical Name:
5-Quinolinecarboxamide, 6-chloro-2-methyl-N-(2-phenylethyl)-
CAS Number:
836611-98-4
Molecular Formula:
C19H17ClN2O
Molecular Weight:
324.8041
IUPAC Name:
6-chloro-2-methyl-N-(2-phenylethyl)quinoline-5-carboxamide
InChI:
InChI=1S/C19H17ClN2O/c1-13-7-8-15-17(22-13)10-9-16(20)18(15)19(23)21-12-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,21,23)
InChI Key:
PXFQSPCEISBBTQ-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(n1)ccc(c2C(=O)NCCc1ccccc1)Cl
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.103g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.808g/mol
Monoisotopic Mass:
324.103g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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