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N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline
TL;DR: N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline (CAS 431883-84-0) is a chemical compound with molecular formula C21H29ClNO3P and molecular weight 409.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline
Also Known As: N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline, diisobutyl ((4-chlorophenyl)(phenylamino)methyl)phosphonate, bis(2-methylpropyl) [(4-chlorophenyl)(phenylamino)methyl]phosphonate
| Molecular Formula | C21H29ClNO3P |
|---|---|
| Molecular Weight | 409.16 g/mol |
| LogP | 6.989 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 409.15735 |
| Heavy Atoms | 27 |
| Complexity | 718.85175 |
Chemical Identifiers
| CAS Number | 431883-84-0 |
|---|---|
| SMILES | CC(C)COP(=O)(C(C1=CC=C(C=C1)Cl)NC2=CC=CC=C2)OCC(C)C |
Product Overview
N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline (CAS 431883-84-0), with molecular formula C21H29ClNO3P and molecular weight 409.16 g/mol. IUPAC: N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline.
Chemical Property Profile of N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline
Property Insights of N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline
The XLogP value of 6.989 indicates that N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline 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-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline?
The CAS number of N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline is 431883-84-0.
What is the molecular formula of N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline?
The molecular formula of N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline is C21H29ClNO3P.
What is the molecular weight of N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline?
The molecular weight of N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline is 409.16 g/mol.
Where can I buy N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline?
You can request a quote for N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for N-[bis(2-methylpropoxy)phosphoryl-(4-chlorophenyl)methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.