ChemDiv1_014147
TL;DR: ChemDiv1_014147 (CAS 393845-41-5) is a chemical compound with molecular formula C19H20ClN5O2 and molecular weight 385.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[1-(4-chlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]piperidine-3-carboxylate
Also Known As: ChemDiv1_014147, ethyl 1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-3-carboxylate, ethyl 1-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-3-carboxylate, 1-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]nipecotic acid ethyl ester, ethyl 1-(1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperidine-3-carboxylate
| Molecular Formula | C19H20ClN5O2 |
|---|---|
| Molecular Weight | 385.13 g/mol |
| LogP | 3.2484 |
| Topological Polar Surface Area | 73.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.13055 |
| Heavy Atoms | 27 |
| Complexity | 956.3934 |
Chemical Identifiers
| CAS Number | 393845-41-5 |
|---|---|
| SMILES | CCOC(=O)C1CCCN(C1)C2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl |
Product Overview
ChemDiv1_014147 (CAS 393845-41-5), with molecular formula C19H20ClN5O2 and molecular weight 385.13 g/mol. IUPAC: ethyl 1-[1-(4-chlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]piperidine-3-carboxylate.
Chemical Property Profile of ChemDiv1_014147
Property Insights of ChemDiv1_014147
The XLogP value of 3.2484 indicates that ChemDiv1_014147 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.14 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014147. Following Lipinski's Rule of Five, ChemDiv1_014147 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 ChemDiv1_014147?
The CAS number of ChemDiv1_014147 is 393845-41-5.
What is the molecular formula of ChemDiv1_014147?
The molecular formula of ChemDiv1_014147 is C19H20ClN5O2.
What is the molecular weight of ChemDiv1_014147?
The molecular weight of ChemDiv1_014147 is 385.13 g/mol.
Where can I buy ChemDiv1_014147?
You can request a quote for ChemDiv1_014147 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014147?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014147 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.