Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride
TL;DR: Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride (CAS 80171-72-8) is a chemical compound with molecular formula C19H31ClN2O3 and molecular weight 370.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-piperidin-1-ium-1-ylethyl N-[2-(butoxymethyl)phenyl]carbamate chloride
Also Known As: AMK 244, 2-Piperidinoethyl o-(butoxymethyl)carbanilate hydrochloride, o-(Butoxymethyl)carbanilic acid 2-piperidinoethyl ester hydrochloride, CARBANILIC ACID, o-(BUTOXYMETHYL)-, 2-PIPERIDINOETHYL ESTER, HYDROCHLORIDE, 2-piperidin-1-ium-1-ylethyl N-[2-(butoxymethyl)phenyl]carbamate chloride
| Molecular Formula | C19H31ClN2O3 |
|---|---|
| Molecular Weight | 370.20 g/mol |
| LogP | -0.38 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 370.20233 |
| Heavy Atoms | 25 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 80171-72-8 |
|---|---|
| SMILES | CCCCOCC1=CC=CC=C1NC(=O)OCC[NH+]2CCCCC2.[Cl-] |
| InChIKey | PQFDEEKYBMGFNZ-UHFFFAOYSA-N |
Product Overview
Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride (CAS 80171-72-8), with molecular formula C19H31ClN2O3 and molecular weight 370.20 g/mol. IUPAC: 2-piperidin-1-ium-1-ylethyl N-[2-(butoxymethyl)phenyl]carbamate chloride.
Chemical Property Profile of Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride
Property Insights of Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride
The XLogP value of -0.38 indicates that Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.0 Ų, Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride has 2 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 Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride?
The CAS number of Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride is 80171-72-8.
What is the molecular formula of Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride?
The molecular formula of Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride is C19H31ClN2O3.
What is the molecular weight of Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride?
The molecular weight of Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride is 370.20 g/mol.
Where can I buy Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride?
You can request a quote for Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl 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-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Carbanilic acid, o-(butoxymethyl)-, 2-piperidinoethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.