TL;DR: Benzenemethanamine, 4-methoxy-N-(4-nitrophenyl)- (CAS 142599-41-5) is a chemical compound with molecular formula C14H14N2O3 and molecular weight 258.10043 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4-methoxyphenyl)methyl]-4-nitroaniline
Also Known As: Benzenemethanamine, 4-methoxy-N-(4-nitrophenyl)-, 4-Nitro-N-(4-methoxybenzyl)aniline, N-(4-Methoxybenzyl)-4-nitroaniline, N-[(4-methoxyphenyl)methyl]-4-nitroaniline, UPCMLD0ENAT5512113:001
| Molecular Formula | C14H14N2O3 |
| Molecular Weight | 258.10043 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 67.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.10043 Da |
| Heavy Atoms | 19 |
| Complexity | 277.0 |
| SMILES | COC1=CC=C(C=C1)CNC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | YSRIXDTZVKGYKM-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that Benzenemethanamine, 4-methoxy-N-(4-nitrophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenemethanamine, 4-methoxy-N-(4-nitrophenyl)-. Following Lipinski's Rule of Five, Benzenemethanamine, 4-methoxy-N-(4-nitrophenyl)- has 1 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 Benzenemethanamine, 4-methoxy-N-(4-nitrophenyl)- is 142599-41-5.
The molecular formula of Benzenemethanamine, 4-methoxy-N-(4-nitrophenyl)- is C14H14N2O3.
The molecular weight of Benzenemethanamine, 4-methoxy-N-(4-nitrophenyl)- is 258.10043 g/mol.
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