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798564-32-6 | Piperazine, 1-(diphenylacetyl)-4-propyl-
CAS No: 798564-32-6 Catalog No: AG00555D MDL No:
Product Description
Catalog Number:
AG00555D
Chemical Name:
Piperazine, 1-(diphenylacetyl)-4-propyl-
CAS Number:
798564-32-6
Molecular Formula:
C21H26N2O
Molecular Weight:
322.4439
IUPAC Name:
2,2-diphenyl-1-(4-propylpiperazin-1-yl)ethanone
InChI:
InChI=1S/C21H26N2O/c1-2-13-22-14-16-23(17-15-22)21(24)20(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,20H,2,13-17H2,1H3
InChI Key:
XOUURCOZKNEHIM-UHFFFAOYSA-N
SMILES:
CCCN1CCN(CC1)C(=O)C(c1ccccc1)c1ccccc1
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.205g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.452g/mol
Monoisotopic Mass:
322.205g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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