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850918-55-7 | 7,14-Dioxa-2,4,10,12-tetraazadispiro[5.1.5.2]pentadecane-1,3,5,9,11,13-hexone, 15-[(1,1-dimethylethyl)imino]-2,4,10,12-tetramethyl-
CAS No: 850918-55-7 Catalog No: AG004OMM MDL No:
Product Description
Catalog Number:
AG004OMM
Chemical Name:
7,14-Dioxa-2,4,10,12-tetraazadispiro[5.1.5.2]pentadecane-1,3,5,9,11,13-hexone, 15-[(1,1-dimethylethyl)imino]-2,4,10,12-tetramethyl-
CAS Number:
850918-55-7
Molecular Formula:
C17H21N5O8
Molecular Weight:
423.3773
IUPAC Name:
15-tert-butylimino-2,4,10,12-tetramethyl-7,14-dioxa-2,4,10,12-tetrazadispiro[5.1.58.26]pentadecane-1,3,5,9,11,13-hexone
InChI:
InChI=1S/C17H21N5O8/c1-15(2,3)18-8-16(9(23)19(4)13(27)20(5)10(16)24)30-17(29-8)11(25)21(6)14(28)22(7)12(17)26/h1-7H3
InChI Key:
QCZRKMLCWGJUKQ-UHFFFAOYSA-N
SMILES:
O=C1N(C)C(=O)C2(C(=O)N1C)OC(=NC(C)(C)C)C1(O2)C(=O)N(C)C(=O)N(C1=O)C
Properties
Complexity:
900
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
423.139g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
423.382g/mol
Monoisotopic Mass:
423.139g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
146A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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