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118236-14-9 | 5H-Oxazolo[3,2-a]thieno[2,3-d]pyrimidin-5-one,2,3-dihydro-
CAS No: 118236-14-9 Catalog No: AG007QGH MDL No:
Product Description
Catalog Number:
AG007QGH
Chemical Name:
5H-Oxazolo[3,2-a]thieno[2,3-d]pyrimidin-5-one,2,3-dihydro-
CAS Number:
118236-14-9
Molecular Formula:
C8H6N2O2S
Molecular Weight:
194.2104
IUPAC Name:
10-oxa-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one
InChI:
InChI=1S/C8H6N2O2S/c11-7-5-1-4-13-6(5)9-8-10(7)2-3-12-8/h1,4H,2-3H2
InChI Key:
KWRTWDCETIZWCH-UHFFFAOYSA-N
SMILES:
O=c1c2ccsc2nc2n1CCO2
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.208g/mol
Monoisotopic Mass:
194.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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