AP-906/41472908
TL;DR: AP-906/41472908 (CAS 455918-71-5) is a chemical compound with molecular formula C25H33N3O5S and molecular weight 487.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethoxy-N-[6-methyl-3-(4-methylpiperazine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
Also Known As: AP-906/41472908, 3,4,5-trimethoxy-N-[6-methyl-3-(4-methylpiperazine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide, 3,4,5-trimethoxy-N-{6-methyl-3-[(4-methyl-1-piperazinyl)carbonyl]-4,5,6,7-tetrahydro-1-benzothien-2-yl}benzamide, N-{6-methyl-3-[(4-methylpiperazinyl)carbonyl](4,5,6,7-tetrahydrobenzo[b]thioph en-2-yl)}(3,4,5-trimethoxyphenyl)carboxamide
| Molecular Formula | C25H33N3O5S |
|---|---|
| Molecular Weight | 487.21 g/mol |
| LogP | 3.5386 |
| Topological Polar Surface Area | 80.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 487.21408 |
| Heavy Atoms | 34 |
| Complexity | 1049.7388 |
Chemical Identifiers
| CAS Number | 455918-71-5 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)N3CCN(CC3)C)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC |
Product Overview
AP-906/41472908 (CAS 455918-71-5), with molecular formula C25H33N3O5S and molecular weight 487.21 g/mol. IUPAC: 3,4,5-trimethoxy-N-[6-methyl-3-(4-methylpiperazine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide.
Chemical Property Profile of AP-906/41472908
Property Insights of AP-906/41472908
The XLogP value of 3.5386 indicates that AP-906/41472908 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-906/41472908. Following Lipinski's Rule of Five, AP-906/41472908 has 1 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 AP-906/41472908?
The CAS number of AP-906/41472908 is 455918-71-5.
What is the molecular formula of AP-906/41472908?
The molecular formula of AP-906/41472908 is C25H33N3O5S.
What is the molecular weight of AP-906/41472908?
The molecular weight of AP-906/41472908 is 487.21 g/mol.
Where can I buy AP-906/41472908?
You can request a quote for AP-906/41472908 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-906/41472908?
Yes, KEHONG BIO provides custom synthesis services for AP-906/41472908 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.