Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate)
TL;DR: Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate) (CAS 10029-24-0) is a chemical compound with molecular formula C23H30N2O4 and molecular weight 398.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[[4-[(1-methoxy-2-methyl-1-oxopropan-2-yl)amino]phenyl]methyl]anilino]-2-methylpropanoate
Also Known As: Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate), methyl 2-[4-[[4-[(1-methoxy-2-methyl-1-oxopropan-2-yl)amino]phenyl]methyl]anilino]-2-methylpropanoate, Dimethyl N,N'-(methylenedi-4,1-phenylene)bis[2-methyl-beta-alaninate], dimethyl N,N/'-(methylenedi-4,1-phenylene)bis[2-methyl-beta-alaninate], Alanine, N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-, dimethyl ester
| Molecular Formula | C23H30N2O4 |
|---|---|
| Molecular Weight | 398.22 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 398.22055 |
| Heavy Atoms | 29 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 10029-24-0 |
|---|---|
| SMILES | CC(C)(C(=O)OC)NC1=CC=C(C=C1)CC2=CC=C(C=C2)NC(C)(C)C(=O)OC |
| InChIKey | XJQDOEYAAOYHLG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate) (CAS 10029-24-0), with molecular formula C23H30N2O4 and molecular weight 398.22 g/mol. IUPAC: methyl 2-[4-[[4-[(1-methoxy-2-methyl-1-oxopropan-2-yl)amino]phenyl]methyl]anilino]-2-methylpropanoate.
Chemical Property Profile of Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate)
Property Insights of Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate)
The XLogP value of 4.8 indicates that Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate). Following Lipinski's Rule of Five, Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate) has 2 hydrogen bond donor(s) and 6 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 Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate)?
The CAS number of Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate) is 10029-24-0.
What is the molecular formula of Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate)?
The molecular formula of Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate) is C23H30N2O4.
What is the molecular weight of Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate)?
The molecular weight of Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate) is 398.22 g/mol.
Where can I buy Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate)?
You can request a quote for Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate)?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl N,N'-(methylenedi-4,1-phenylene)bis(2-methyl-beta-alaninate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.