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832735-71-4 | Piperazine, 1-(3-chlorophenyl)-4-[(2-phenyl-1-indolizinyl)carbonyl]-
CAS No: 832735-71-4 Catalog No: AG004XHL MDL No:
Product Description
Catalog Number:
AG004XHL
Chemical Name:
Piperazine, 1-(3-chlorophenyl)-4-[(2-phenyl-1-indolizinyl)carbonyl]-
CAS Number:
832735-71-4
Molecular Formula:
C25H22ClN3O
Molecular Weight:
415.9147
IUPAC Name:
[4-(3-chlorophenyl)piperazin-1-yl]-(2-phenylindolizin-1-yl)methanone
InChI:
InChI=1S/C25H22ClN3O/c26-20-9-6-10-21(17-20)27-13-15-28(16-14-27)25(30)24-22(19-7-2-1-3-8-19)18-29-12-5-4-11-23(24)29/h1-12,17-18H,13-16H2
InChI Key:
JDCGBIUINPXHGV-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)N1CCN(CC1)C(=O)c1c(cn2c1cccc2)c1ccccc1
Properties
Complexity:
587
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
415.145g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
415.921g/mol
Monoisotopic Mass:
415.145g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
28A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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