BRD-K61394235-001-01-3
TL;DR: BRD-K61394235-001-01-3 (CAS 393846-43-0) is a chemical compound with molecular formula C19H22N6O2 and molecular weight 366.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[1-(3-methylphenyl)pyrazolo[5,4-d]pyrimidin-4-yl]piperazine-1-carboxylate
Also Known As: BRD-K61394235-001-01-3, ethyl 4-[1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate, ethyl 4-[1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate, ethyl 4-(1-(m-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate
| Molecular Formula | C19H22N6O2 |
|---|---|
| Molecular Weight | 366.18 g/mol |
| LogP | 2.40242 |
| Topological Polar Surface Area | 76.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.18042 |
| Heavy Atoms | 27 |
| Complexity | 961.7432 |
Chemical Identifiers
| CAS Number | 393846-43-0 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C2=NC=NC3=C2C=NN3C4=CC=CC(=C4)C |
Product Overview
BRD-K61394235-001-01-3 (CAS 393846-43-0), with molecular formula C19H22N6O2 and molecular weight 366.18 g/mol. IUPAC: ethyl 4-[1-(3-methylphenyl)pyrazolo[5,4-d]pyrimidin-4-yl]piperazine-1-carboxylate.
Chemical Property Profile of BRD-K61394235-001-01-3
Property Insights of BRD-K61394235-001-01-3
The XLogP value of 2.40242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BRD-K61394235-001-01-3. The TPSA of 76.38 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K61394235-001-01-3. Following Lipinski's Rule of Five, BRD-K61394235-001-01-3 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 BRD-K61394235-001-01-3?
The CAS number of BRD-K61394235-001-01-3 is 393846-43-0.
What is the molecular formula of BRD-K61394235-001-01-3?
The molecular formula of BRD-K61394235-001-01-3 is C19H22N6O2.
What is the molecular weight of BRD-K61394235-001-01-3?
The molecular weight of BRD-K61394235-001-01-3 is 366.18 g/mol.
Where can I buy BRD-K61394235-001-01-3?
You can request a quote for BRD-K61394235-001-01-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K61394235-001-01-3?
Yes, KEHONG BIO provides custom synthesis services for BRD-K61394235-001-01-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.