TL;DR: 1-(4-chloro-2-fluorophenyl)-1H-pyrrole-2,5-dione (CAS 134220-36-3) is a chemical compound with molecular formula C10H5ClFNO2 and molecular weight 224.99928 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chloro-2-fluorophenyl)pyrrole-2,5-dione
Also Known As: 1-(4-chloro-2-fluorophenyl)-1H-pyrrole-2,5-dione, 1-(4-chloro-2-fluorophenyl)pyrrole-2,5-dione, 8G-047, 1-(4-chloro-2-fluorophenyl)-2,5-dihydro-1H-pyrrole-2,5-dione
| Molecular Formula | C10H5ClFNO2 |
| Molecular Weight | 224.99928 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 224.99928 Da |
| Heavy Atoms | 15 |
| Complexity | 313.0 |
| SMILES | C1=CC(=C(C=C1Cl)F)N2C(=O)C=CC2=O |
| InChIKey | MQPARVALDWDOQL-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-chloro-2-fluorophenyl)-1H-pyrrole-2,5-dione. With a topological polar surface area (TPSA) of 37.4 Ų, 1-(4-chloro-2-fluorophenyl)-1H-pyrrole-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-chloro-2-fluorophenyl)-1H-pyrrole-2,5-dione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(4-chloro-2-fluorophenyl)-1H-pyrrole-2,5-dione is 134220-36-3.
The molecular formula of 1-(4-chloro-2-fluorophenyl)-1H-pyrrole-2,5-dione is C10H5ClFNO2.
The molecular weight of 1-(4-chloro-2-fluorophenyl)-1H-pyrrole-2,5-dione is 224.99928 g/mol.
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