TL;DR: Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester (CAS 141380-75-8) is a chemical compound with molecular formula C15H17N2O5P and molecular weight 336.0875 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[dimethoxyphosphoryl-(4-nitrophenyl)methyl]aniline
Also Known As: N-[dimethoxyphosphoryl-(4-nitrophenyl)methyl]aniline, dimethyl [(4-nitrophenyl)(phenylamino)methyl]phosphonate, Dimethyl [anilino(4-nitrophenyl)methyl]phosphonate, Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester, alpha-Anilino-4-nitrobenzylphosphonic acid dimethyl ester
| Molecular Formula | C15H17N2O5P |
| Molecular Weight | 336.0875 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 93.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.0875 Da |
| Heavy Atoms | 23 |
| Complexity | 420.0 |
| SMILES | COP(=O)(C(C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC=CC=C2)OC |
| InChIKey | DRMKQTHRBPDLFD-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester. Following Lipinski's Rule of Five, Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester 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 Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester is 141380-75-8.
The molecular formula of Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester is C15H17N2O5P.
The molecular weight of Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester is 336.0875 g/mol.
You can request a quote for Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 141380-75-8. Our professional technical team will respond with pricing and lead time.