![2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate structure](/static/products/1334/13347-41-6.webp)
2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate
TL;DR: 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate (CAS 13347-41-6) is a chemical compound with molecular formula C22H27NO3 and molecular weight 353.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[di(propan-2-yl)amino]ethyl 9H-xanthene-9-carboxylate
Also Known As: propantheline, 2-[(DIISOPROPYL)AMINO]ETHYL 9H-XANTHENE-9-CARBOXYLATE, 2-[di(propan-2-yl)amino]ethyl 9H-xanthene-9-carboxylate, 2-di-isopropylaminoethylxanthen-9-carboxylate, 2-(Diisopropylamino)ethyl 9H-xanthene-9-carboxylate
| Molecular Formula | C22H27NO3 |
|---|---|
| Molecular Weight | 353.20 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 353.1991 |
| Heavy Atoms | 26 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 13347-41-6 |
|---|---|
| SMILES | CC(C)N(CCOC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13)C(C)C |
| InChIKey | SKMKGLSIZVBHQB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate (CAS 13347-41-6), with molecular formula C22H27NO3 and molecular weight 353.20 g/mol. IUPAC: 2-[di(propan-2-yl)amino]ethyl 9H-xanthene-9-carboxylate.
Chemical Property Profile of 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate
Property Insights of 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate
The XLogP value of 4.2 indicates that 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate has 0 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 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate?
The CAS number of 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate is 13347-41-6.
What is the molecular formula of 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate?
The molecular formula of 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate is C22H27NO3.
What is the molecular weight of 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate?
The molecular weight of 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate is 353.20 g/mol.
Where can I buy 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate?
You can request a quote for 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Diisopropyl)amino]ethyl 9H-xanthene-9-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.