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1017472-05-7 | Piperazine, 1-(2-phenylethyl)-4-(2-pyrrolidinylmethyl)-
CAS No: 1017472-05-7 Catalog No: AG0005DL MDL No:
Product Description
Catalog Number:
AG0005DL
Chemical Name:
Piperazine, 1-(2-phenylethyl)-4-(2-pyrrolidinylmethyl)-
CAS Number:
1017472-05-7
Molecular Formula:
C17H27N3
Molecular Weight:
273.4164
IUPAC Name:
1-(2-phenylethyl)-4-(pyrrolidin-2-ylmethyl)piperazine
InChI:
InChI=1S/C17H27N3/c1-2-5-16(6-3-1)8-10-19-11-13-20(14-12-19)15-17-7-4-9-18-17/h1-3,5-6,17-18H,4,7-15H2
InChI Key:
GYDLYWZZHZBONS-UHFFFAOYSA-N
SMILES:
C1CNC(C1)CN1CCN(CC1)CCc1ccccc1
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.22g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.424g/mol
Monoisotopic Mass:
273.22g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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