AP-906/41881146
TL;DR: AP-906/41881146 (CAS 686283-89-6) is a chemical compound with molecular formula C22H24N2O3S and molecular weight 396.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-[(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)methyl]benzoate
Also Known As: AP-906/41881146, F3098-5448, isopropyl 4-((7-methyl-4-oxo-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)methyl)benzoate, isopropyl 4-[(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)methyl]benzoate, propan-2-yl 4-[(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)methyl]benzoate
| Molecular Formula | C22H24N2O3S |
|---|---|
| Molecular Weight | 396.15 g/mol |
| LogP | 4.1963 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.15076 |
| Heavy Atoms | 28 |
| Complexity | 1079.5952 |
Chemical Identifiers
| CAS Number | 686283-89-6 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C=N3)CC4=CC=C(C=C4)C(=O)OC(C)C |
Product Overview
AP-906/41881146 (CAS 686283-89-6), with molecular formula C22H24N2O3S and molecular weight 396.15 g/mol. IUPAC: propan-2-yl 4-[(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)methyl]benzoate.
Chemical Property Profile of AP-906/41881146
Property Insights of AP-906/41881146
The XLogP value of 4.1963 indicates that AP-906/41881146 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-906/41881146. Following Lipinski's Rule of Five, AP-906/41881146 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 AP-906/41881146?
The CAS number of AP-906/41881146 is 686283-89-6.
What is the molecular formula of AP-906/41881146?
The molecular formula of AP-906/41881146 is C22H24N2O3S.
What is the molecular weight of AP-906/41881146?
The molecular weight of AP-906/41881146 is 396.15 g/mol.
Where can I buy AP-906/41881146?
You can request a quote for AP-906/41881146 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-906/41881146?
Yes, KEHONG BIO provides custom synthesis services for AP-906/41881146 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.