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Home > Quinoline > 130132-97-7
130132-97-7 | 2(1H)-Quinolinone, 4-[2-[4-(1-naphthalenyl)-1-piperazinyl]ethyl]-
CAS No: 130132-97-7 Catalog No: AG000U1U MDL No:
Product Description
Catalog Number:
AG000U1U
Chemical Name:
2(1H)-Quinolinone, 4-[2-[4-(1-naphthalenyl)-1-piperazinyl]ethyl]-
CAS Number:
130132-97-7
Molecular Formula:
C25H25N3O
Molecular Weight:
383.4855
IUPAC Name:
4-[2-(4-naphthalen-1-ylpiperazin-1-yl)ethyl]-1H-quinolin-2-one
InChI:
InChI=1S/C25H25N3O/c29-25-18-20(21-8-3-4-10-23(21)26-25)12-13-27-14-16-28(17-15-27)24-11-5-7-19-6-1-2-9-22(19)24/h1-11,18H,12-17H2,(H,26,29)
InChI Key:
RCKCNANCMIDXQM-UHFFFAOYSA-N
SMILES:
O=c1cc(CCN2CCN(CC2)c2cccc3c2cccc3)c2c([nH]1)cccc2
Properties
Complexity:
609
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
383.2g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
383.495g/mol
Monoisotopic Mass:
383.2g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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