TL;DR: (4-(4-Nitrophenyl)phenyl) N-(3-methoxyphenyl)carbamate (CAS 122861-92-1) is a chemical compound with molecular formula C20H16N2O5 and molecular weight 364.10593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(4-nitrophenyl)phenyl] N-(3-methoxyphenyl)carbamate
Also Known As: (4-(4-Nitrophenyl)phenyl) N-(3-methoxyphenyl)carbamate, [4-(4-nitrophenyl)phenyl] N-(3-methoxyphenyl)carbamate, 4'-Nitro[1,1'-biphenyl]-4-yl (3-methoxyphenyl)carbamate
| Molecular Formula | C20H16N2O5 |
| Molecular Weight | 364.10593 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 93.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 364.10593 Da |
| Heavy Atoms | 27 |
| Complexity | 493.0 |
| SMILES | COC1=CC=CC(=C1)NC(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | QQIDCLMJARWERV-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that (4-(4-Nitrophenyl)phenyl) N-(3-methoxyphenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-(4-Nitrophenyl)phenyl) N-(3-methoxyphenyl)carbamate. Following Lipinski's Rule of Five, (4-(4-Nitrophenyl)phenyl) N-(3-methoxyphenyl)carbamate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (4-(4-Nitrophenyl)phenyl) N-(3-methoxyphenyl)carbamate is 122861-92-1.
The molecular formula of (4-(4-Nitrophenyl)phenyl) N-(3-methoxyphenyl)carbamate is C20H16N2O5.
The molecular weight of (4-(4-Nitrophenyl)phenyl) N-(3-methoxyphenyl)carbamate is 364.10593 g/mol.
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