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1397176-18-9 | Acetamide, 2-chloro-N-[3-(1-methylethyl)phenyl]-N-(3-pyridinylmethyl)-
CAS No: 1397176-18-9 Catalog No: AG001BJN MDL No:
Product Description
Catalog Number:
AG001BJN
Chemical Name:
Acetamide, 2-chloro-N-[3-(1-methylethyl)phenyl]-N-(3-pyridinylmethyl)-
CAS Number:
1397176-18-9
Molecular Formula:
C17H19ClN2O
Molecular Weight:
302.7986
IUPAC Name:
2-chloro-N-(3-propan-2-ylphenyl)-N-(pyridin-3-ylmethyl)acetamide
InChI:
InChI=1S/C17H19ClN2O/c1-13(2)15-6-3-7-16(9-15)20(17(21)10-18)12-14-5-4-8-19-11-14/h3-9,11,13H,10,12H2,1-2H3
InChI Key:
HIWFEHNERWWFIG-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(c1cccc(c1)C(C)C)Cc1cccnc1
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.119g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.802g/mol
Monoisotopic Mass:
302.119g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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