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Home > Other Heterocycles > 1422138-82-6
1422138-82-6 | 8-pyrimidin-2-yl-1,11-dioxa-4,8-diazaspiro[5.6]dodecane
CAS No: 1422138-82-6 Catalog No: AG01DHNF MDL No:
Product Description
Catalog Number:
AG01DHNF
Chemical Name:
8-pyrimidin-2-yl-1,11-dioxa-4,8-diazaspiro[5.6]dodecane
CAS Number:
1422138-82-6
Molecular Formula:
C12H18N4O2
Molecular Weight:
250.2969
IUPAC Name:
8-pyrimidin-2-yl-1,11-dioxa-4,8-diazaspiro[5.6]dodecane
InChI:
InChI=1S/C12H18N4O2/c1-2-14-11(15-3-1)16-5-7-17-10-12(9-16)8-13-4-6-18-12/h1-3,13H,4-10H2
InChI Key:
USICMJJUULYOAE-UHFFFAOYSA-N
SMILES:
C1COC2(CN1)COCCN(C2)c1ncccn1
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.143g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.302g/mol
Monoisotopic Mass:
250.143g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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