(4-oxo-1,3-diphenylquinolizin-2-yl) acetate

C23H17NO3 — CID 110273347

IUPAC(4-oxo-1,3-diphenylquinolizin-2-yl) acetate
SMILESCC(=O)Oc1c(-c2ccccc2)c(=O)n2ccccc2c1-c1ccccc1
InChIInChI=1S/C23H17NO3/c1-16(25)27-22-20(17-10-4-2-5-11-17)19-14-8-9-15-24(19)23(26)21(22)18-12-6-3-7-13-18/h2-15H,1H3
InChIKeyQXRNJVJVUNULQQ-UHFFFAOYSA-N
MW355.39 g/mol
LogP4.56
Rot. Bonds3

About (4-oxo-1,3-diphenylquinolizin-2-yl) acetate

(4-oxo-1,3-diphenylquinolizin-2-yl) acetate (PubChem CID 110273347) has the molecular formula C23H17NO3 and a molecular weight of 355.39 g/mol. Its IUPAC name is (4-oxo-1,3-diphenylquinolizin-2-yl) acetate.

Molecular Properties

Compound Name(4-oxo-1,3-diphenylquinolizin-2-yl) acetate
PubChem CID110273347
Molecular FormulaC23H17NO3
Molecular Weight355.39 g/mol
Exact Mass355.12
IUPAC Name(4-oxo-1,3-diphenylquinolizin-2-yl) acetate
SMILESCC(=O)Oc1c(-c2ccccc2)c(=O)n2ccccc2c1-c1ccccc1
InChIInChI=1S/C23H17NO3/c1-16(25)27-22-20(17-10-4-2-5-11-17)19-14-8-9-15-24(19)23(26)21(22)18-12-6-3-7-13-18/h2-15H,1H3
InChIKeyQXRNJVJVUNULQQ-UHFFFAOYSA-N
XLogP4.56
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

7-phenylbenzo[a]quinolizin-6-one
CID 132564756
2-[3-[1-(2-acetyloxyethyl)-2-phenylindolizin-3-yl]-2-phenylindolizin-1-yl]ethyl acetate
CID 10940674
methyl 1-benzoyl-2-phenylindolizine-3-carboxylate
CID 23251514
(3-acetyloxy-1-methyl-2-oxoquinolin-4-yl) acetate
CID 19776662
2-[3-[1-(2-hydroxyethyl)-2-phenylindolizin-3-yl]-2-phenylindolizin-1-yl]ethyl acetate
CID 11005771
(2-tert-butyl-4,5-diphenylfuran-3-yl) acetate
CID 11336580
7-(4-chlorophenyl)benzo[a]quinolizin-6-one
CID 132564751
(1-acetyl-2-methylindol-3-yl) acetate
CID 15565752
(3,11-dioxo-10,12-diphenyl-2-oxatricyclo[6.4.1.04,13]trideca-1(12),4,6,8(13),9-pentaen-9-yl) acetate
CID 5245721
methyl 3-benzyl-2-phenylindolizine-1-carboxylate
CID 138982755
ethyl 2-[2-(4-bromophenyl)-1-phenylindolizin-3-yl]-2-oxoacetate
CID 67106331
(1,2-diacetylindol-3-yl) acetate
CID 31196222

Frequently Asked Questions

What is the IUPAC name of (4-oxo-1,3-diphenylquinolizin-2-yl) acetate?
The IUPAC name of (4-oxo-1,3-diphenylquinolizin-2-yl) acetate (CID 110273347) is (4-oxo-1,3-diphenylquinolizin-2-yl) acetate.
What is the SMILES notation for (4-oxo-1,3-diphenylquinolizin-2-yl) acetate?
The canonical SMILES for (4-oxo-1,3-diphenylquinolizin-2-yl) acetate is CC(=O)Oc1c(-c2ccccc2)c(=O)n2ccccc2c1-c1ccccc1.
What is the InChIKey of (4-oxo-1,3-diphenylquinolizin-2-yl) acetate?
The InChIKey is QXRNJVJVUNULQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17NO3/c1-16(25)27-22-20(17-10-4-2-5-11-17)19-14-8-9-15-24(19)23(26)21(22)18-12-6-3-7-13-18/h2-15H,1H3.
What are the key properties of (4-oxo-1,3-diphenylquinolizin-2-yl) acetate?
(4-oxo-1,3-diphenylquinolizin-2-yl) acetate has a molecular weight of 355.39 g/mol, XLogP of 4.56, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-oxo-1,3-diphenylquinolizin-2-yl) acetate is sourced from PubChem (CID 110273347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).