Bionet1_003143
TL;DR: Bionet1_003143 (CAS 339019-52-2) is a chemical compound with molecular formula C18H21FN4O2S and molecular weight 376.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[4-(2-fluorophenyl)piperazin-1-yl]-2-methylsulfanylpyrimidine-5-carboxylate
Also Known As: Bionet1_003143, ethyl 4-[4-(2-fluorophenyl)piperazino]-2-(methylsulfanyl)-5-pyrimidinecarboxylate, 7N-520S, ethyl 4-[4-(2-fluorophenyl)piperazin-1-yl]-2-(methylsulfanyl)pyrimidine-5-carboxylate, ethyl 4-[4-(2-fluorophenyl)piperazin-1-yl]-2-methylsulfanylpyrimidine-5-carboxylate
| Molecular Formula | C18H21FN4O2S |
|---|---|
| Molecular Weight | 376.14 g/mol |
| LogP | 2.8409 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.13693 |
| Heavy Atoms | 26 |
| Complexity | 781.53644 |
Chemical Identifiers
| CAS Number | 339019-52-2 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1N2CCN(CC2)C3=CC=CC=C3F)SC |
Product Overview
Bionet1_003143 (CAS 339019-52-2), with molecular formula C18H21FN4O2S and molecular weight 376.14 g/mol. IUPAC: ethyl 4-[4-(2-fluorophenyl)piperazin-1-yl]-2-methylsulfanylpyrimidine-5-carboxylate.
Chemical Property Profile of Bionet1_003143
Property Insights of Bionet1_003143
The XLogP value of 2.8409 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_003143. With a topological polar surface area (TPSA) of 58.56 Ų, Bionet1_003143 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_003143 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 Bionet1_003143?
The CAS number of Bionet1_003143 is 339019-52-2.
What is the molecular formula of Bionet1_003143?
The molecular formula of Bionet1_003143 is C18H21FN4O2S.
What is the molecular weight of Bionet1_003143?
The molecular weight of Bionet1_003143 is 376.14 g/mol.
Where can I buy Bionet1_003143?
You can request a quote for Bionet1_003143 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003143?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003143 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.