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923861-60-3 | 1-{[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl}piperazine
CAS No: 923861-60-3 Catalog No: AG019Y90 MDL No:MFCD08691275
Product Description
Catalog Number:
AG019Y90
Chemical Name:
1-{[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl}piperazine
CAS Number:
923861-60-3
Molecular Formula:
C15H19N3OS
Molecular Weight:
289.3959
MDL Number:
MFCD08691275
IUPAC Name:
2-(4-methoxyphenyl)-4-(piperazin-1-ylmethyl)-1,3-thiazole
InChI:
InChI=1S/C15H19N3OS/c1-19-14-4-2-12(3-5-14)15-17-13(11-20-15)10-18-8-6-16-7-9-18/h2-5,11,16H,6-10H2,1H3
InChI Key:
MYZADMABZHURQK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1scc(n1)CN1CCNCC1
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.125g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.397g/mol
Monoisotopic Mass:
289.125g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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