![Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate structure](/static/products/846/846594-56-7.png)
Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate
TL;DR: Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate (CAS 846594-56-7) is a chemical compound with molecular formula C18H18ClN3O3 and molecular weight 359.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate
Also Known As: ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate, 1-(8-chlorobenzofuro[3,2-d]pyrimidin-4-yl)isonipecotic acid ethyl ester, ethyl 1-(8-chlorobenzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate, 1-(8-chloro-4-benzofuro[3,2-d]pyrimidinyl)-4-piperidinecarboxylic acid ethyl ester, ethyl 1-(8-chloranyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate
| Molecular Formula | C18H18ClN3O3 |
|---|---|
| Molecular Weight | 359.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.10367 |
| Heavy Atoms | 25 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 846594-56-7 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)C2=NC=NC3=C2OC4=C3C=C(C=C4)Cl |
| InChIKey | BVTLOWWZKVIBGC-UHFFFAOYSA-N |
Product Overview
Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate (CAS 846594-56-7), with molecular formula C18H18ClN3O3 and molecular weight 359.10 g/mol. IUPAC: ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate.
Chemical Property Profile of Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate
Property Insights of Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate
The XLogP value of 3.8 indicates that Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate has 0 hydrogen bond donor(s) and 6 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 Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate?
The CAS number of Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate is 846594-56-7.
What is the molecular formula of Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate?
The molecular formula of Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate is C18H18ClN3O3.
What is the molecular weight of Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate?
The molecular weight of Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate is 359.10 g/mol.
Where can I buy Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate?
You can request a quote for Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(8-chloro-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.