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3458-63-7 | 4-[[2-[4-(Methylsulfonyl)phenyl]imidazo[1,2-a]pyrimidin-3-yl]methyl]-1-piperazineethanol
CAS No: 3458-63-7 Catalog No: AG00CZJQ MDL No:
Product Description
Catalog Number:
AG00CZJQ
Chemical Name:
4-[[2-[4-(Methylsulfonyl)phenyl]imidazo[1,2-a]pyrimidin-3-yl]methyl]-1-piperazineethanol
CAS Number:
3458-63-7
IUPAC Name:
2-[4-[[2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methyl]piperazin-1-yl]ethanol
InChI:
InChI=1S/C20H25N5O3S/c1-29(27,28)17-5-3-16(4-6-17)19-18(25-8-2-7-21-20(25)22-19)15-24-11-9-23(10-12-24)13-14-26/h2-8,26H,9-15H2,1H3
InChI Key:
JXZZQZRHAGLPCB-UHFFFAOYSA-N
Properties
Complexity:
627
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
415.168g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
415.512g/mol
Monoisotopic Mass:
415.168g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
99.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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