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918891-46-0 | 5H-Thiazolo[3,2-a]pyrimidin-5-one, 6-ethyl-7-(4-methyl-2-thiazolyl)-
CAS No: 918891-46-0 Catalog No: AG006ANE MDL No:
Product Description
Catalog Number:
AG006ANE
Chemical Name:
5H-Thiazolo[3,2-a]pyrimidin-5-one, 6-ethyl-7-(4-methyl-2-thiazolyl)-
CAS Number:
918891-46-0
Molecular Formula:
C12H11N3OS2
Molecular Weight:
277.3652
IUPAC Name:
6-ethyl-7-(4-methyl-1,3-thiazol-2-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
InChI:
InChI=1S/C12H11N3OS2/c1-3-8-9(10-13-7(2)6-18-10)14-12-15(11(8)16)4-5-17-12/h4-6H,3H2,1-2H3
InChI Key:
MMRMLVHKSRQPHE-UHFFFAOYSA-N
SMILES:
CCc1c(nc2n(c1=O)ccs2)c1scc(n1)C
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.034g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.36g/mol
Monoisotopic Mass:
277.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
99.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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