AQ-750/42051186
TL;DR: AQ-750/42051186 (CAS 690962-16-4) is a chemical compound with molecular formula C23H24FN3O3S and molecular weight 441.15 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-dimethylthiophen-2-yl]benzamide
Also Known As: AQ-750/42051186, VU0618242-1, F3394-0822, 4-fluoro-N-(3-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-4,5-dimethylthiophen-2-yl)benzamide, 4-fluoro-N-(3-((4-(furan-2-carbonyl)piperazin-1-yl)methyl)-4,5-dimethylthiophen-2-yl)benzamide
| Molecular Formula | C23H24FN3O3S |
|---|---|
| Molecular Weight | 441.15 g/mol |
| LogP | 4.30734 |
| Topological Polar Surface Area | 65.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.15225 |
| Heavy Atoms | 31 |
| Complexity | 1068.4392 |
Chemical Identifiers
| CAS Number | 690962-16-4 |
|---|---|
| SMILES | CC1=C(SC(=C1CN2CCN(CC2)C(=O)C3=CC=CO3)NC(=O)C4=CC=C(C=C4)F)C |
Product Overview
AQ-750/42051186 (CAS 690962-16-4), with molecular formula C23H24FN3O3S and molecular weight 441.15 g/mol. IUPAC: 4-fluoro-N-[3-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-4,5-dimethylthiophen-2-yl]benzamide.
Chemical Property Profile of AQ-750/42051186
Property Insights of AQ-750/42051186
The XLogP value of 4.30734 indicates that AQ-750/42051186 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-750/42051186. Following Lipinski's Rule of Five, AQ-750/42051186 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-750/42051186?
The CAS number of AQ-750/42051186 is 690962-16-4.
What is the molecular formula of AQ-750/42051186?
The molecular formula of AQ-750/42051186 is C23H24FN3O3S.
What is the molecular weight of AQ-750/42051186?
The molecular weight of AQ-750/42051186 is 441.15 g/mol.
Where can I buy AQ-750/42051186?
You can request a quote for AQ-750/42051186 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-750/42051186?
Yes, KEHONG BIO provides custom synthesis services for AQ-750/42051186 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.