TL;DR: C24H16ClFN2O5 (CAS 1022818-81-0) is a chemical compound with molecular formula C24H16ClFN2O5 and molecular weight 466.07318 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[3-(2-chloro-6-fluorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoic acid
Also Known As: 4-(3-(2-chloro-6-fluorophenyl)-4,6-dioxo-2-phenyltetrahydro-2H-pyrrolo[3,4-d]isoxazol-5(3H)-yl)benzoic acid, 4-[3-(2-chloro-6-fluorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoic acid, 4-[3-(2-chloro-6-fluorophenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoic acid, C24H16ClFN2O5
| Molecular Formula | C24H16ClFN2O5 |
| Molecular Weight | 466.07318 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 87.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 466.07318 Da |
| Heavy Atoms | 33 |
| Complexity | 785.0 |
| SMILES | C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O)C5=C(C=CC=C5Cl)F |
| InChIKey | MXXPUJAGPGEIGE-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that C24H16ClFN2O5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.2 Ų falls within the moderate polarity range, balancing permeability and solubility for C24H16ClFN2O5. Following Lipinski's Rule of Five, C24H16ClFN2O5 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of C24H16ClFN2O5 is 1022818-81-0.
The molecular formula of C24H16ClFN2O5 is C24H16ClFN2O5.
The molecular weight of C24H16ClFN2O5 is 466.07318 g/mol.
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