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39567-23-2 | 5H-Thiazolo[3,2-a]pyrimidin-5-one,7-ethyl-2,3,6,7-tetrahydro-
CAS No: 39567-23-2 Catalog No: AG00789B MDL No:MFCD01939221
Product Description
Catalog Number:
AG00789B
Chemical Name:
5H-Thiazolo[3,2-a]pyrimidin-5-one,7-ethyl-2,3,6,7-tetrahydro-
CAS Number:
39567-23-2
Molecular Formula:
C8H12N2OS
Molecular Weight:
184.2587
MDL Number:
MFCD01939221
IUPAC Name:
7-ethyl-2,3,6,7-tetrahydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
InChI:
InChI=1S/C8H12N2OS/c1-2-6-5-7(11)10-3-4-12-8(10)9-6/h6H,2-5H2,1H3
InChI Key:
MXUQQHNDCAKLIS-UHFFFAOYSA-N
SMILES:
CCC1CC(=O)N2C(=N1)SCC2
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.067g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.257g/mol
Monoisotopic Mass:
184.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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