Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride
TL;DR: Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride (CAS 17095-90-8) is a chemical compound with molecular formula C18H29ClN2O2 and molecular weight 340.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[2-[(2-methylphenyl)carbamoyloxy]cyclohexyl]azanium chloride
Also Known As: K 1401, o-Methylcarbanilic acid 2-(diethylamino)cyclohexyl ester hydrochloride, CARBANILIC ACID, o-METHYL-, 2-(DIETHYLAMINO)CYCLOHEXYL ESTER, HYDROCHLORIDE, diethyl-[2-[(2-methylphenyl)carbamoyloxy]cyclohexyl]azanium chloride
| Molecular Formula | C18H29ClN2O2 |
|---|---|
| Molecular Weight | 340.19 g/mol |
| LogP | -0.22 |
| Topological Polar Surface Area | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 340.19174 |
| Heavy Atoms | 23 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 17095-90-8 |
|---|---|
| SMILES | CC[NH+](CC)C1CCCCC1OC(=O)NC2=CC=CC=C2C.[Cl-] |
| InChIKey | WYGAZVGAZYSQFJ-UHFFFAOYSA-N |
Product Overview
Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride (CAS 17095-90-8), with molecular formula C18H29ClN2O2 and molecular weight 340.19 g/mol. IUPAC: diethyl-[2-[(2-methylphenyl)carbamoyloxy]cyclohexyl]azanium chloride.
Chemical Property Profile of Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride
Property Insights of Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride
The XLogP value of -0.22 indicates that Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride has 2 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 Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride?
The CAS number of Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride is 17095-90-8.
What is the molecular formula of Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride?
The molecular formula of Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride is C18H29ClN2O2.
What is the molecular weight of Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride?
The molecular weight of Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride is 340.19 g/mol.
Where can I buy Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride?
You can request a quote for Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Carbanilic acid, o-methyl-, 2-(diethylamino)cyclohexyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.