F1874-0023
TL;DR: F1874-0023 (CAS 848896-91-3) is a chemical compound with molecular formula C20H22N6O3S and molecular weight 426.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)sulfanylacetyl]piperazine-1-carboxylate
Also Known As: F1874-0023, ethyl 4-[2-({1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}sulfanyl)acetyl]piperazine-1-carboxylate, ethyl 4-(2-((1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio)acetyl)piperazine-1-carboxylate, ethyl 4-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]piperazine-1-carboxylate
| Molecular Formula | C20H22N6O3S |
|---|---|
| Molecular Weight | 426.15 g/mol |
| LogP | 2.2083 |
| Topological Polar Surface Area | 93.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.1474 |
| Heavy Atoms | 30 |
| Complexity | 1033.4576 |
Chemical Identifiers
| CAS Number | 848896-91-3 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4 |
Product Overview
F1874-0023 (CAS 848896-91-3), with molecular formula C20H22N6O3S and molecular weight 426.15 g/mol. IUPAC: ethyl 4-[2-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)sulfanylacetyl]piperazine-1-carboxylate.
Chemical Property Profile of F1874-0023
Property Insights of F1874-0023
The XLogP value of 2.2083 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1874-0023. The TPSA of 93.45 Ų falls within the moderate polarity range, balancing permeability and solubility for F1874-0023. Following Lipinski's Rule of Five, F1874-0023 has 0 hydrogen bond donor(s) and 7 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 F1874-0023?
The CAS number of F1874-0023 is 848896-91-3.
What is the molecular formula of F1874-0023?
The molecular formula of F1874-0023 is C20H22N6O3S.
What is the molecular weight of F1874-0023?
The molecular weight of F1874-0023 is 426.15 g/mol.
Where can I buy F1874-0023?
You can request a quote for F1874-0023 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1874-0023?
Yes, KEHONG BIO provides custom synthesis services for F1874-0023 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.