TL;DR: 2-[2-(Diethoxyphosphorylmethyl)phenyl]isoindole-1,3-dione (CAS 140150-99-8) is a chemical compound with molecular formula C19H20NO5P and molecular weight 373.1079 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(diethoxyphosphorylmethyl)phenyl]isoindole-1,3-dione
Also Known As: 2-[2-(diethoxyphosphorylmethyl)phenyl]isoindole-1,3-dione, diethyl {[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)phenyl]methyl}phosphonate, diethyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzylphosphonate, diethyl{[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)phenyl]methyl}phosphonate
| Molecular Formula | C19H20NO5P |
| Molecular Weight | 373.1079 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 72.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 373.1079 Da |
| Heavy Atoms | 26 |
| Complexity | 546.0 |
| SMILES | CCOP(=O)(CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C2=O)OCC |
| InChIKey | WKMJYHVQGRUZGG-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(Diethoxyphosphorylmethyl)phenyl]isoindole-1,3-dione. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(Diethoxyphosphorylmethyl)phenyl]isoindole-1,3-dione. Following Lipinski's Rule of Five, 2-[2-(Diethoxyphosphorylmethyl)phenyl]isoindole-1,3-dione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[2-(Diethoxyphosphorylmethyl)phenyl]isoindole-1,3-dione is 140150-99-8.
The molecular formula of 2-[2-(Diethoxyphosphorylmethyl)phenyl]isoindole-1,3-dione is C19H20NO5P.
The molecular weight of 2-[2-(Diethoxyphosphorylmethyl)phenyl]isoindole-1,3-dione is 373.1079 g/mol.
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