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132786-14-2 | 2-Oxazolamine, 4,5-dihydro-5-[[4-(4-methoxyphenyl)-1-piperazinyl]methyl]-
CAS No: 132786-14-2 Catalog No: AG00116J MDL No:
Product Description
Catalog Number:
AG00116J
Chemical Name:
2-Oxazolamine, 4,5-dihydro-5-[[4-(4-methoxyphenyl)-1-piperazinyl]methyl]-
CAS Number:
132786-14-2
Molecular Formula:
C15H22N4O2
Molecular Weight:
290.3608
IUPAC Name:
5-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4,5-dihydro-1,3-oxazol-2-amine
InChI:
InChI=1S/C15H22N4O2/c1-20-13-4-2-12(3-5-13)19-8-6-18(7-9-19)11-14-10-17-15(16)21-14/h2-5,14H,6-11H2,1H3,(H2,16,17)
InChI Key:
MBLSJHGGVBNRPT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N1CCN(CC1)CC1CN=C(O1)N
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.174g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.367g/mol
Monoisotopic Mass:
290.174g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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