ChemDiv1_014410
TL;DR: ChemDiv1_014410 (CAS 393845-36-8) 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-4-carboxylate
Also Known As: ChemDiv1_014410, BRD-K59350800-001-07-1, ethyl 1-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxylate, ethyl 1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxylate, 1-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]isonipecotic acid ethyl ester
| Molecular Formula | C19H20ClN5O2 |
|---|---|
| Molecular Weight | 385.13 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.13055 |
| Heavy Atoms | 27 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 393845-36-8 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)C2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl |
| InChIKey | CDQPPGQYXPJXKI-UHFFFAOYSA-N |
Product Overview
ChemDiv1_014410 (CAS 393845-36-8), 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-4-carboxylate.
Chemical Property Profile of ChemDiv1_014410
Property Insights of ChemDiv1_014410
The XLogP value of 3.6 indicates that ChemDiv1_014410 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014410. Following Lipinski's Rule of Five, ChemDiv1_014410 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_014410?
The CAS number of ChemDiv1_014410 is 393845-36-8.
What is the molecular formula of ChemDiv1_014410?
The molecular formula of ChemDiv1_014410 is C19H20ClN5O2.
What is the molecular weight of ChemDiv1_014410?
The molecular weight of ChemDiv1_014410 is 385.13 g/mol.
Where can I buy ChemDiv1_014410?
You can request a quote for ChemDiv1_014410 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014410?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014410 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.