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Home > Imidazoles > 681260-16-2
681260-16-2 | 6-(4-Methoxy-phenyl)-5-piperazin-1-ylmethyl-imidazo[2,1-b]thiazole
CAS No: 681260-16-2 Catalog No: AG01EWXL MDL No:MFCD03789023
Product Description
Catalog Number:
AG01EWXL
Chemical Name:
6-(4-Methoxy-phenyl)-5-piperazin-1-ylmethyl-imidazo[2,1-b]thiazole
CAS Number:
681260-16-2
Molecular Formula:
C17H20N4OS
Molecular Weight:
328.4319
MDL Number:
MFCD03789023
IUPAC Name:
6-(4-methoxyphenyl)-5-(piperazin-1-ylmethyl)imidazo[2,1-b][1,3]thiazole
InChI:
InChI=1S/C17H20N4OS/c1-22-14-4-2-13(3-5-14)16-15(12-20-8-6-18-7-9-20)21-10-11-23-17(21)19-16/h2-5,10-11,18H,6-9,12H2,1H3
InChI Key:
RIUFPBDOAONMSK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nc2n(c1CN1CCNCC1)ccs2
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.136g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
328.434g/mol
Monoisotopic Mass:
328.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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