TL;DR: AP-906/42287328 (CAS 1005085-32-4) is a chemical compound with molecular formula C27H24N2O6 and molecular weight 472.16342 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[5-(4-methoxyphenyl)-2-(2-methylphenyl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoate
Also Known As: AP-906/42287328, F1593-0025, methyl 4-(5-(4-methoxyphenyl)-4,6-dioxo-2-(o-tolyl)hexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)benzoate, methyl 4-[5-(4-methoxyphenyl)-2-(2-methylphenyl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoate, methyl 4-[5-(4-methoxyphenyl)-2-(2-methylphenyl)-4,6-dioxo-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoate
| Molecular Formula | C27H24N2O6 |
| Molecular Weight | 472.16342 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 85.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.16342 Da |
| Heavy Atoms | 35 |
| Complexity | 803.0 |
| SMILES | CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)C(=O)OC |
| InChIKey | OUYUPEFSEAUGIP-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that AP-906/42287328 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-906/42287328. Following Lipinski's Rule of Five, AP-906/42287328 has 0 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 AP-906/42287328 is 1005085-32-4.
The molecular formula of AP-906/42287328 is C27H24N2O6.
The molecular weight of AP-906/42287328 is 472.16342 g/mol.
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