Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate
TL;DR: Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate (CAS 64049-91-8) is a chemical compound with molecular formula C18H23ClN2O2 and molecular weight 334.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium chloride
Also Known As: Carbamic acid, methyl-, (5-(benzyldimethylammonio)-o-tolyl) ester, chloride, Ammonium, (3-(methylcarbamoyloxy)-p-tolyl)benzyldimethyl-, chloride, AMMONIUM, (3-HYDROXY-p-TOLYL)BENZYLDIMETHYL-, CHLORIDE, METHYLCARBAMATE, Carbamic acid, N-methyl-, 2-methyl-5-(N-benzyl-N-methylamino)phenyl ester, methochloride, benzyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium chloride
| Molecular Formula | C18H23ClN2O2 |
|---|---|
| Molecular Weight | 334.14 g/mol |
| LogP | 0.48 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.1448 |
| Heavy Atoms | 23 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 64049-91-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](C)(C)CC2=CC=CC=C2)OC(=O)NC.[Cl-] |
| InChIKey | PGQWTFKQXYTWCK-UHFFFAOYSA-N |
Product Overview
Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate (CAS 64049-91-8), with molecular formula C18H23ClN2O2 and molecular weight 334.14 g/mol. IUPAC: benzyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium chloride.
Chemical Property Profile of Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate
Property Insights of Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate
The XLogP value of 0.48 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate 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 Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate?
The CAS number of Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate is 64049-91-8.
What is the molecular formula of Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate?
The molecular formula of Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate is C18H23ClN2O2.
What is the molecular weight of Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate?
The molecular weight of Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate is 334.14 g/mol.
Where can I buy Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate?
You can request a quote for Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (3-hydroxy-p-tolyl)benzyldimethyl-, chloride, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.