AQ-750/42051185
TL;DR: AQ-750/42051185 (CAS 690962-15-3) is a chemical compound with molecular formula C25H26FN3O3S and molecular weight 467.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-N-[3-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
Also Known As: AQ-750/42051185, F3394-0821, 4-fluoro-N-(3-((4-(furan-2-carbonyl)piperazin-1-yl)methyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)benzamide, 4-FLUORO-N-(3-{[4-(FURAN-2-CARBONYL)PIPERAZIN-1-YL]METHYL}-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-2-YL)BENZAMIDE, 4-fluoro-N-[3-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
| Molecular Formula | C25H26FN3O3S |
|---|---|
| Molecular Weight | 467.17 g/mol |
| LogP | 4.5693 |
| Topological Polar Surface Area | 65.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 467.16788 |
| Heavy Atoms | 33 |
| Complexity | 1132.6162 |
Chemical Identifiers
| CAS Number | 690962-15-3 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)F)CN4CCN(CC4)C(=O)C5=CC=CO5 |
Product Overview
AQ-750/42051185 (CAS 690962-15-3), with molecular formula C25H26FN3O3S and molecular weight 467.17 g/mol. IUPAC: 4-fluoro-N-[3-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide.
Chemical Property Profile of AQ-750/42051185
Property Insights of AQ-750/42051185
The XLogP value of 4.5693 indicates that AQ-750/42051185 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.79 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-750/42051185. Following Lipinski's Rule of Five, AQ-750/42051185 has 1 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 AQ-750/42051185?
The CAS number of AQ-750/42051185 is 690962-15-3.
What is the molecular formula of AQ-750/42051185?
The molecular formula of AQ-750/42051185 is C25H26FN3O3S.
What is the molecular weight of AQ-750/42051185?
The molecular weight of AQ-750/42051185 is 467.17 g/mol.
Where can I buy AQ-750/42051185?
You can request a quote for AQ-750/42051185 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-750/42051185?
Yes, KEHONG BIO provides custom synthesis services for AQ-750/42051185 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.