Tolycaine
TL;DR: Tolycaine (CAS 3686-58-6) is a chemical compound with molecular formula C15H22N2O3 and molecular weight 278.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(diethylamino)acetyl]amino]-3-methylbenzoate
Also Known As: Tolycaine, Tolicaina, Tolycainum, Baycain, Tolycain
| Molecular Formula | C15H22N2O3 |
|---|---|
| Molecular Weight | 278.16 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 278.16306 |
| Heavy Atoms | 20 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 3686-58-6 |
|---|---|
| SMILES | CCN(CC)CC(=O)NC1=C(C=CC=C1C(=O)OC)C |
| InChIKey | UDKICLZCJWQTLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tolycaine (CAS 3686-58-6), with molecular formula C15H22N2O3 and molecular weight 278.16 g/mol. IUPAC: methyl 2-[[2-(diethylamino)acetyl]amino]-3-methylbenzoate.
Chemical Property Profile of Tolycaine
Property Insights of Tolycaine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tolycaine. With a topological polar surface area (TPSA) of 58.6 Ų, Tolycaine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tolycaine has 1 hydrogen bond donor(s) and 4 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 Tolycaine?
The CAS number of Tolycaine is 3686-58-6.
What is the molecular formula of Tolycaine?
The molecular formula of Tolycaine is C15H22N2O3.
What is the molecular weight of Tolycaine?
The molecular weight of Tolycaine is 278.16 g/mol.
Where can I buy Tolycaine?
You can request a quote for Tolycaine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tolycaine?
Yes, KEHONG BIO provides custom synthesis services for Tolycaine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.