TL;DR: [4-(1',3'-dioxo-2-pyridin-3-ylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1-carbonyl)phenyl] acetate (CAS 1217859-59-0) is a chemical compound with molecular formula C34H24N2O5 and molecular weight 540.1685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(1',3'-dioxo-2-pyridin-3-ylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1-carbonyl)phenyl] acetate
Also Known As: [4-(1',3'-dioxo-2-pyridin-3-ylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1-carbonyl)phenyl] acetate|1'-[4-(Acetyloxy)benzoyl]-1',2'-dihydro-2'-(3-pyridinyl)spiro[2H-indene-2,3'(3'aH)-pyrrolo[1,2-a]quinoline]-1,3-dione|1a(2)-[4-(Acetyloxy)benzoyl]-1a(2),2a(2)-dihydro-2a(2)-(3-pyridinyl)spiro[2H-indene-2,3a(2)(3a(2)aH)-pyrrolo[1,2-a]quinoline]-1,3-dione|4-{[1,3-dioxo-2'-(pyridin-3-yl)-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinolin]-1'-yl]carbonyl}phenyl acetate|STL233517
| Molecular Formula | C34H24N2O5 |
| Molecular Weight | 540.1685 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 93.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 540.1685 Da |
| Heavy Atoms | 41 |
| Complexity | 1080.0 |
| SMILES | CC(=O)OC1=CC=C(C=C1)C(=O)C2C(C3(C4N2C5=CC=CC=C5C=C4)C(=O)C6=CC=CC=C6C3=O)C7=CN=CC=C7 |
| InChIKey | GIWHFOAGGSDEJP-UHFFFAOYSA-N |
The XLogP value of 5.1 indicates that [4-(1',3'-dioxo-2-pyridin-3-ylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1-carbonyl)phenyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(1',3'-dioxo-2-pyridin-3-ylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1-carbonyl)phenyl] acetate. Following Lipinski's Rule of Five, [4-(1',3'-dioxo-2-pyridin-3-ylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1-carbonyl)phenyl] acetate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of [4-(1',3'-dioxo-2-pyridin-3-ylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1-carbonyl)phenyl] acetate is 1217859-59-0.
The molecular formula of [4-(1',3'-dioxo-2-pyridin-3-ylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1-carbonyl)phenyl] acetate is C34H24N2O5.
The molecular weight of [4-(1',3'-dioxo-2-pyridin-3-ylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1-carbonyl)phenyl] acetate is 540.1685 g/mol.
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