BIM-0041489.P001
TL;DR: BIM-0041489.P001 (CAS 6039-76-5) is a chemical compound with molecular formula C18H19FN2O2S and molecular weight 346.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-fluoro-2-methyl-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]ethanone
Also Known As: BIM-0041489.P001, 1-{5-fluoro-2-methyl-4-[4-(2-thienylcarbonyl)-1-piperazinyl]phenyl}ethanone, A2602/0110589, Ethanone, 1-[3-fluoro-6-methyl-4-[4-(2-thenoyl)-1-piperazinyl]phenyl]-, 1-[5-fluoro-2-methyl-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]ethanone
| Molecular Formula | C18H19FN2O2S |
|---|---|
| Molecular Weight | 346.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.1151 |
| Heavy Atoms | 24 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 6039-76-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C(=O)C)F)N2CCN(CC2)C(=O)C3=CC=CS3 |
| InChIKey | KTPHLDWDVDFFOM-UHFFFAOYSA-N |
Product Overview
BIM-0041489.P001 (CAS 6039-76-5), with molecular formula C18H19FN2O2S and molecular weight 346.12 g/mol. IUPAC: 1-[5-fluoro-2-methyl-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]ethanone.
Chemical Property Profile of BIM-0041489.P001
Property Insights of BIM-0041489.P001
The XLogP value of 3.1 indicates that BIM-0041489.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0041489.P001. Following Lipinski's Rule of Five, BIM-0041489.P001 has 0 hydrogen bond donor(s) and 5 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 BIM-0041489.P001?
The CAS number of BIM-0041489.P001 is 6039-76-5.
What is the molecular formula of BIM-0041489.P001?
The molecular formula of BIM-0041489.P001 is C18H19FN2O2S.
What is the molecular weight of BIM-0041489.P001?
The molecular weight of BIM-0041489.P001 is 346.12 g/mol.
Where can I buy BIM-0041489.P001?
You can request a quote for BIM-0041489.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0041489.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0041489.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.