Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate
TL;DR: Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate (CAS 6452-64-8) is a chemical compound with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(dimethylamino)methyl]-3,5-dimethylphenyl] N-methylcarbamate
Also Known As: Thompson-hayward T-H 255-I, WE 417, TH 255-I, ENT 27,328-X, Thompson-Hayward T-H-255-I
| Molecular Formula | C13H20N2O2 |
|---|---|
| Molecular Weight | 236.15 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.15248 |
| Heavy Atoms | 17 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 6452-64-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1CN(C)C)C)OC(=O)NC |
| InChIKey | PBJQYLSKNASHPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate (CAS 6452-64-8), with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol. IUPAC: [4-[(dimethylamino)methyl]-3,5-dimethylphenyl] N-methylcarbamate.
Chemical Property Profile of Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate
Property Insights of Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate. With a topological polar surface area (TPSA) of 41.6 Ų, Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate has 1 hydrogen bond donor(s) and 3 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 Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate?
The CAS number of Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate is 6452-64-8.
What is the molecular formula of Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate?
The molecular formula of Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate is C13H20N2O2.
What is the molecular weight of Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate?
The molecular weight of Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate is 236.15 g/mol.
Where can I buy Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate?
You can request a quote for Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.