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Home > Other Heterocycles > 646056-37-3
646056-37-3 | 1,7-Diazaspiro[4.4]nonane, 7-methyl-1-(5-pyrimidinyl)-
CAS No: 646056-37-3 Catalog No: AG006SPY MDL No:
Product Description
Catalog Number:
AG006SPY
Chemical Name:
1,7-Diazaspiro[4.4]nonane, 7-methyl-1-(5-pyrimidinyl)-
CAS Number:
646056-37-3
Molecular Formula:
C12H18N4
Molecular Weight:
218.2981
IUPAC Name:
7-methyl-1-pyrimidin-5-yl-1,7-diazaspiro[4.4]nonane
InChI:
InChI=1S/C12H18N4/c1-15-6-4-12(9-15)3-2-5-16(12)11-7-13-10-14-8-11/h7-8,10H,2-6,9H2,1H3
InChI Key:
RIXKBENZAAKEKO-UHFFFAOYSA-N
SMILES:
CN1CCC2(C1)CCCN2c1cncnc1
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.153g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.304g/mol
Monoisotopic Mass:
218.153g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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