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Home > Thiazole > 1177276-52-6
1177276-52-6 | 7-(piperazin-1-ylmethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one dihydrochloride
CAS No: 1177276-52-6 Catalog No: AG00HE1W MDL No:MFCD07687289
Product Description
Catalog Number:
AG00HE1W
Chemical Name:
7-(piperazin-1-ylmethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one dihydrochloride
CAS Number:
1177276-52-6
Molecular Formula:
C11H16Cl2N4OS
Molecular Weight:
323.2419
MDL Number:
MFCD07687289
IUPAC Name:
7-(piperazin-1-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one;dihydrochloride
InChI:
InChI=1S/C11H14N4OS.2ClH/c16-10-7-9(8-14-3-1-12-2-4-14)13-11-15(10)5-6-17-11;;/h5-7,12H,1-4,8H2;2*1H
InChI Key:
JRZIAXUCGGVUHY-UHFFFAOYSA-N
SMILES:
O=c1cc(CN2CCNCC2)nc2n1ccs2.Cl.Cl
Properties
Complexity:
423
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.042g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
323.236g/mol
Monoisotopic Mass:
322.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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