Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride
TL;DR: Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride (CAS 13210-13-4) is a chemical compound with molecular formula C22H26ClNO3 and molecular weight 387.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-piperidin-1-ylethyl 2-(9H-xanthen-9-yl)acetate;hydrochloride
Also Known As: 2-Piperidinoethyl xanthene-9-acetate hydrochloride, 2-Piperidinoethyl 9-xanthenylacetate hydrochloride, Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride, 2-piperidin-1-ylethyl 2-(9H-xanthen-9-yl)acetate hydrochloride, 2-(Piperidin-1-yl)ethyl (9H-xanthen-9-yl)acetate--hydrogen chloride (1/1)
| Molecular Formula | C22H26ClNO3 |
|---|---|
| Molecular Weight | 387.16 g/mol |
| LogP | 4.7652 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.16013 |
| Heavy Atoms | 27 |
| Complexity | 440.0 |
Chemical Identifiers
| CAS Number | 13210-13-4 |
|---|---|
| SMILES | C1CCN(CC1)CCOC(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24.Cl |
| InChIKey | QOXTVRBLDWEWBS-UHFFFAOYSA-N |
Product Overview
Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride (CAS 13210-13-4), with molecular formula C22H26ClNO3 and molecular weight 387.16 g/mol. IUPAC: 2-piperidin-1-ylethyl 2-(9H-xanthen-9-yl)acetate;hydrochloride.
Chemical Property Profile of Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride
Property Insights of Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride
The XLogP value of 4.7652 indicates that Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride 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 Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride?
The CAS number of Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride is 13210-13-4.
What is the molecular formula of Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride?
The molecular formula of Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride is C22H26ClNO3.
What is the molecular weight of Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride?
The molecular weight of Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride is 387.16 g/mol.
Where can I buy Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride?
You can request a quote for Xanthene-9-acetic acid, 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 Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Xanthene-9-acetic acid, 2-piperidinoethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.