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N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline
TL;DR: N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline (CAS 331655-49-3) is a chemical compound with molecular formula C21H30NO3P and molecular weight 375.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline
Also Known As: BAS 00259701, N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline, 4-isopropylphenyl P-methyl-N-[4-(pentyloxy)phenyl]phosphonamidoate
| Molecular Formula | C21H30NO3P |
|---|---|
| Molecular Weight | 375.20 g/mol |
| LogP | 6.6928 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 375.19632 |
| Heavy Atoms | 26 |
| Complexity | 711.04095 |
Chemical Identifiers
| CAS Number | 331655-49-3 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)NP(=O)(C)OC2=CC=C(C=C2)C(C)C |
Product Overview
N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline (CAS 331655-49-3), with molecular formula C21H30NO3P and molecular weight 375.20 g/mol. IUPAC: N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline.
Chemical Property Profile of N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline
Property Insights of N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline
The XLogP value of 6.6928 indicates that N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline?
The CAS number of N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline is 331655-49-3.
What is the molecular formula of N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline?
The molecular formula of N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline is C21H30NO3P.
What is the molecular weight of N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline?
The molecular weight of N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline is 375.20 g/mol.
Where can I buy N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline?
You can request a quote for N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[methyl-(4-propan-2-ylphenoxy)phosphoryl]-4-pentoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.