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Home > Pyridines > 832735-06-5
832735-06-5 | Pyrimidine, 2-[(1-cyclopentyl-4-piperidinyl)oxy]-5-(6-ethyl-3-pyridinyl)-
CAS No: 832735-06-5 Catalog No: AG004TB0 MDL No:
Product Description
Catalog Number:
AG004TB0
Chemical Name:
Pyrimidine, 2-[(1-cyclopentyl-4-piperidinyl)oxy]-5-(6-ethyl-3-pyridinyl)-
CAS Number:
832735-06-5
Molecular Formula:
C21H28N4O
Molecular Weight:
352.4732
IUPAC Name:
2-(1-cyclopentylpiperidin-4-yl)oxy-5-(6-ethylpyridin-3-yl)pyrimidine
InChI:
InChI=1S/C21H28N4O/c1-2-18-8-7-16(13-22-18)17-14-23-21(24-15-17)26-20-9-11-25(12-10-20)19-5-3-4-6-19/h7-8,13-15,19-20H,2-6,9-12H2,1H3
InChI Key:
SHGHKBSQGTVRCY-UHFFFAOYSA-N
SMILES:
CCc1ccc(cn1)c1cnc(nc1)OC1CCN(CC1)C1CCCC1
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.226g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.482g/mol
Monoisotopic Mass:
352.226g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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