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873075-51-5 | 3-methyl-1-(1,3-thiazol-2-yl)piperazine
CAS No: 873075-51-5 Catalog No: AG00JSVL MDL No:
Product Description
Catalog Number:
AG00JSVL
Chemical Name:
3-methyl-1-(1,3-thiazol-2-yl)piperazine
CAS Number:
873075-51-5
Molecular Formula:
C8H13N3S
Molecular Weight:
183.2739
IUPAC Name:
2-(3-methylpiperazin-1-yl)-1,3-thiazole
InChI:
InChI=1S/C8H13N3S/c1-7-6-11(4-2-9-7)8-10-3-5-12-8/h3,5,7,9H,2,4,6H2,1H3
InChI Key:
SBBSBSJOPQYMFO-UHFFFAOYSA-N
SMILES:
CC1NCCN(C1)c1nccs1
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.083g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.273g/mol
Monoisotopic Mass:
183.083g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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