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190013-22-0 | Methanone, 1,4-dioxa-8-azaspiro[4.5]dec-8-yl-5-thiazolyl-
CAS No: 190013-22-0 Catalog No: AG002E9C MDL No:
Product Description
Catalog Number:
AG002E9C
Chemical Name:
Methanone, 1,4-dioxa-8-azaspiro[4.5]dec-8-yl-5-thiazolyl-
CAS Number:
190013-22-0
Molecular Formula:
C11H14N2O3S
Molecular Weight:
254.3055
IUPAC Name:
1,4-dioxa-8-azaspiro[4.5]decan-8-yl(1,3-thiazol-5-yl)methanone
InChI:
InChI=1S/C11H14N2O3S/c14-10(9-7-12-8-17-9)13-3-1-11(2-4-13)15-5-6-16-11/h7-8H,1-6H2
InChI Key:
HACSLIMIURXCBN-UHFFFAOYSA-N
SMILES:
O=C(c1scnc1)N1CCC2(CC1)OCCO2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.073g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.304g/mol
Monoisotopic Mass:
254.073g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
79.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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