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89622-97-9 | Methanone, (2-butyl-3-indolizinyl)[4-[3-(propylamino)propoxy]phenyl]-
CAS No: 89622-97-9 Catalog No: AG003X09 MDL No:
Product Description
Catalog Number:
AG003X09
Chemical Name:
Methanone, (2-butyl-3-indolizinyl)[4-[3-(propylamino)propoxy]phenyl]-
CAS Number:
89622-97-9
Molecular Formula:
C25H32N2O2
Molecular Weight:
392.5338
IUPAC Name:
(2-butylindolizin-3-yl)-[4-[3-(propylamino)propoxy]phenyl]methanone
InChI:
InChI=1S/C25H32N2O2/c1-3-5-9-21-19-22-10-6-7-17-27(22)24(21)25(28)20-11-13-23(14-12-20)29-18-8-16-26-15-4-2/h6-7,10-14,17,19,26H,3-5,8-9,15-16,18H2,1-2H3
InChI Key:
ZFNIDHLEUHLDRX-UHFFFAOYSA-N
SMILES:
CCCNCCCOc1ccc(cc1)C(=O)c1c(CCCC)cc2n1cccc2
Properties
Complexity:
475
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.246g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
392.543g/mol
Monoisotopic Mass:
392.246g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
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