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918481-16-0 | Piperazine, 1-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-(3-phenylpropyl)-
CAS No: 918481-16-0 Catalog No: AG006Q6X MDL No:
Product Description
Catalog Number:
AG006Q6X
Chemical Name:
Piperazine, 1-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-(3-phenylpropyl)-
CAS Number:
918481-16-0
Molecular Formula:
C19H27N3O
Molecular Weight:
313.4372
IUPAC Name:
3,5-dimethyl-4-[[4-(3-phenylpropyl)piperazin-1-yl]methyl]-1,2-oxazole
InChI:
InChI=1S/C19H27N3O/c1-16-19(17(2)23-20-16)15-22-13-11-21(12-14-22)10-6-9-18-7-4-3-5-8-18/h3-5,7-8H,6,9-15H2,1-2H3
InChI Key:
ZWVGDANVJISJSB-UHFFFAOYSA-N
SMILES:
Cc1onc(c1CN1CCN(CC1)CCCc1ccccc1)C
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.215g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.445g/mol
Monoisotopic Mass:
313.215g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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