4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride
TL;DR: 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride (CAS 61612-62-2) is a chemical compound with molecular formula C21H25ClN2O3 and molecular weight 388.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-4-[(4-methylphenyl)iminomethyl]phenyl] 2-pyrrolidin-1-ylacetate;hydrochloride
Also Known As: 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride, 1-Pyrrolidineacetic acid, 2-methoxy-4-(((4-methylphenyl)imino)methyl)phenyl ester, monohydrochloride, [2-methoxy-4-[(4-methylphenyl)iminomethyl]phenyl] 2-pyrrolidin-1-ylacetate hydrochloride
| Molecular Formula | C21H25ClN2O3 |
|---|---|
| Molecular Weight | 388.16 g/mol |
| LogP | 4.17722 |
| Topological Polar Surface Area | 51.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 388.15536 |
| Heavy Atoms | 27 |
| Complexity | 784.5138 |
Chemical Identifiers
| CAS Number | 61612-62-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N=CC2=CC(=C(C=C2)OC(=O)CN3CCCC3)OC.Cl |
Product Overview
4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride (CAS 61612-62-2), with molecular formula C21H25ClN2O3 and molecular weight 388.16 g/mol. IUPAC: [2-methoxy-4-[(4-methylphenyl)iminomethyl]phenyl] 2-pyrrolidin-1-ylacetate;hydrochloride.
Chemical Property Profile of 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride
Property Insights of 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride
The XLogP value of 4.17722 indicates that 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.13 Ų, 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride?
The CAS number of 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride is 61612-62-2.
What is the molecular formula of 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride?
The molecular formula of 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride is C21H25ClN2O3.
What is the molecular weight of 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride?
The molecular weight of 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride is 388.16 g/mol.
Where can I buy 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride?
You can request a quote for 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylanilino-(3-methoxy-4-pyrrolidinoacetoxy)benzylidene hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.