TL;DR: 2-[Bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol (CAS 151918-92-2) is a chemical compound with molecular formula C18H17NO6 and molecular weight 343.1056 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol
Also Known As: CBKinase1_000458, CBKinase1_012858, 2-[bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol, BAS 00612977, BIM-0027726.P001
| Molecular Formula | C18H17NO6 |
| Molecular Weight | 343.1056 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.1056 Da |
| Heavy Atoms | 25 |
| Complexity | 449.0 |
| SMILES | CC1=CC=C(O1)C(C2=CC=C(O2)C)C3=C(C(=CC(=C3)OC)[N+](=O)[O-])O |
| InChIKey | MUGSZWVLVMWCTO-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that 2-[Bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol. Following Lipinski's Rule of Five, 2-[Bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[Bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol is 151918-92-2.
The molecular formula of 2-[Bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol is C18H17NO6.
The molecular weight of 2-[Bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol is 343.1056 g/mol.
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