Carbamic acid, N-methyl-, 3-diethylaminophenyl ester
TL;DR: Carbamic acid, N-methyl-, 3-diethylaminophenyl ester (CAS 2631-26-7) is a chemical compound with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(diethylamino)phenyl] N-methylcarbamate
Also Known As: starbld0037253, 3-Diethylaminophenyl N-methylcarbamate, Probes1_000344, Probes2_000031, [3-(diethylamino)phenyl] N-methylcarbamate
| Molecular Formula | C12H18N2O2 |
|---|---|
| Molecular Weight | 222.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 222.13683 |
| Heavy Atoms | 16 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 2631-26-7 |
|---|---|
| SMILES | CCN(CC)C1=CC(=CC=C1)OC(=O)NC |
| InChIKey | CZZWOJXFCKBYNE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carbamic acid, N-methyl-, 3-diethylaminophenyl ester (CAS 2631-26-7), with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol. IUPAC: [3-(diethylamino)phenyl] N-methylcarbamate.
Chemical Property Profile of Carbamic acid, N-methyl-, 3-diethylaminophenyl ester
Property Insights of Carbamic acid, N-methyl-, 3-diethylaminophenyl ester
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, N-methyl-, 3-diethylaminophenyl ester. With a topological polar surface area (TPSA) of 41.6 Ų, Carbamic acid, N-methyl-, 3-diethylaminophenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, N-methyl-, 3-diethylaminophenyl ester 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 Carbamic acid, N-methyl-, 3-diethylaminophenyl ester?
The CAS number of Carbamic acid, N-methyl-, 3-diethylaminophenyl ester is 2631-26-7.
What is the molecular formula of Carbamic acid, N-methyl-, 3-diethylaminophenyl ester?
The molecular formula of Carbamic acid, N-methyl-, 3-diethylaminophenyl ester is C12H18N2O2.
What is the molecular weight of Carbamic acid, N-methyl-, 3-diethylaminophenyl ester?
The molecular weight of Carbamic acid, N-methyl-, 3-diethylaminophenyl ester is 222.14 g/mol.
Where can I buy Carbamic acid, N-methyl-, 3-diethylaminophenyl ester?
You can request a quote for Carbamic acid, N-methyl-, 3-diethylaminophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, N-methyl-, 3-diethylaminophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, N-methyl-, 3-diethylaminophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.