TL;DR: AR-D45 Dimethyl 4,5-phenanthrenedicarboxylate (CAS 124974-15-8) is a chemical compound with molecular formula C18H14O4 and molecular weight 294.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl phenanthrene-4,5-dicarboxylate
Also Known As: Dimethyl Phenanthrene-4,5-dicarboxylate, ar-d45 dimethyl 4,5-phenanthrenedicarboxylate, 4,5-dimethyl phenanthrene-4,5-dicarboxylate, J1.081.378F, Phenanthrene-4,5-dicarboxylic acid dimethyl ester
| Molecular Formula | C18H14O4 |
| Molecular Weight | 294.0892 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.0892 Da |
| Heavy Atoms | 22 |
| Complexity | 393.0 |
| SMILES | COC(=O)C1=CC=CC2=C1C3=C(C=CC=C3C(=O)OC)C=C2 |
| InChIKey | NFLMOBWVQTWVJO-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that AR-D45 Dimethyl 4,5-phenanthrenedicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, AR-D45 Dimethyl 4,5-phenanthrenedicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AR-D45 Dimethyl 4,5-phenanthrenedicarboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AR-D45 Dimethyl 4,5-phenanthrenedicarboxylate is 124974-15-8.
The molecular formula of AR-D45 Dimethyl 4,5-phenanthrenedicarboxylate is C18H14O4.
The molecular weight of AR-D45 Dimethyl 4,5-phenanthrenedicarboxylate is 294.0892 g/mol.
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