TL;DR: 1'-Benzoyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-7'-methylspiro[2H-indene-2,3'(3'aH)-pyrrolo[1,2-a]quinoline]-1,3-dione (CAS 1217649-26-7) is a chemical compound with molecular formula C36H29NO5 and molecular weight 555.2046 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzoyl-2-(2,5-dimethoxyphenyl)-7-methylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1',3'-dione
Also Known As: 1'-Benzoyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-7'-methylspiro[2H-indene-2,3'(3'aH)-pyrrolo[1,2-a]quinoline]-1,3-dione, 1'-Benzoyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-7'-methylspiro(2H-indene-2,3'(3'aH)-pyrrolo(1,2-a)quinoline)-1,3-dione, 1-benzoyl-2-(2,5-dimethoxyphenyl)-7-methylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1',3'-dione, 1a(2)-Benzoyl-2a(2)-(2,5-dimethoxyphenyl)-1a(2),2a(2)-dihydro-7a(2)-methylspiro[2H-indene-2,3a(2)(3a(2)aH)-pyrrolo[1,2-a]quinoline]-1,3-dione, 2'-(2,5-dimethoxyphenyl)-7'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
| Molecular Formula | C36H29NO5 |
| Molecular Weight | 555.2046 g/mol |
| XLogP | 6.7 |
| Topological Polar Surface Area (TPSA) | 72.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 555.2046 Da |
| Heavy Atoms | 42 |
| Complexity | 1070.0 |
| SMILES | CC1=CC2=C(C=C1)N3C(C=C2)C4(C(C3C(=O)C5=CC=CC=C5)C6=C(C=CC(=C6)OC)OC)C(=O)C7=CC=CC=C7C4=O |
| InChIKey | MWWZEEPKRJMQBE-UHFFFAOYSA-N |
The XLogP value of 6.7 indicates that 1'-Benzoyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-7'-methylspiro[2H-indene-2,3'(3'aH)-pyrrolo[1,2-a]quinoline]-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1'-Benzoyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-7'-methylspiro[2H-indene-2,3'(3'aH)-pyrrolo[1,2-a]quinoline]-1,3-dione. Following Lipinski's Rule of Five, 1'-Benzoyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-7'-methylspiro[2H-indene-2,3'(3'aH)-pyrrolo[1,2-a]quinoline]-1,3-dione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1'-Benzoyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-7'-methylspiro[2H-indene-2,3'(3'aH)-pyrrolo[1,2-a]quinoline]-1,3-dione is 1217649-26-7.
The molecular formula of 1'-Benzoyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-7'-methylspiro[2H-indene-2,3'(3'aH)-pyrrolo[1,2-a]quinoline]-1,3-dione is C36H29NO5.
The molecular weight of 1'-Benzoyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-7'-methylspiro[2H-indene-2,3'(3'aH)-pyrrolo[1,2-a]quinoline]-1,3-dione is 555.2046 g/mol.
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