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159692-83-8 | Pyrimidine, 2-(4-hexyl-1-piperazinyl)-
CAS No: 159692-83-8 Catalog No: AG001RB8 MDL No:
Product Description
Catalog Number:
AG001RB8
Chemical Name:
Pyrimidine, 2-(4-hexyl-1-piperazinyl)-
CAS Number:
159692-83-8
Molecular Formula:
C14H24N4
Molecular Weight:
248.3672
IUPAC Name:
2-(4-hexylpiperazin-1-yl)pyrimidine
InChI:
InChI=1S/C14H24N4/c1-2-3-4-5-9-17-10-12-18(13-11-17)14-15-7-6-8-16-14/h6-8H,2-5,9-13H2,1H3
InChI Key:
NMLFFNFMMVUNMP-UHFFFAOYSA-N
SMILES:
CCCCCCN1CCN(CC1)c1ncccn1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.2g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.374g/mol
Monoisotopic Mass:
248.2g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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