AB00592588-06
TL;DR: AB00592588-06 (CAS 866894-70-4) is a chemical compound with molecular formula C22H21N3O5S and molecular weight 439.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(2-methoxyethyl)-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide
Also Known As: AB00592588-06, F1607-0476, 2-[[3-(2-methoxyethyl)-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide, 2-{[3-(2-methoxyethyl)-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]thio}-N-(3-methoxyphenyl)acetamide, 2-{[5-(2-methoxyethyl)-6-oxo-8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,10,12-pentaen-4-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
| Molecular Formula | C22H21N3O5S |
|---|---|
| Molecular Weight | 439.12 g/mol |
| LogP | 3.5285 |
| Topological Polar Surface Area | 95.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 439.12018 |
| Heavy Atoms | 31 |
| Complexity | 1297.5343 |
Chemical Identifiers
| CAS Number | 866894-70-4 |
|---|---|
| SMILES | COCCN1C(=O)C2=C(C3=CC=CC=C3O2)N=C1SCC(=O)NC4=CC(=CC=C4)OC |
Product Overview
AB00592588-06 (CAS 866894-70-4), with molecular formula C22H21N3O5S and molecular weight 439.12 g/mol. IUPAC: 2-[[3-(2-methoxyethyl)-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide.
Chemical Property Profile of AB00592588-06
Property Insights of AB00592588-06
The XLogP value of 3.5285 indicates that AB00592588-06 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.59 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00592588-06. Following Lipinski's Rule of Five, AB00592588-06 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 AB00592588-06?
The CAS number of AB00592588-06 is 866894-70-4.
What is the molecular formula of AB00592588-06?
The molecular formula of AB00592588-06 is C22H21N3O5S.
What is the molecular weight of AB00592588-06?
The molecular weight of AB00592588-06 is 439.12 g/mol.
Where can I buy AB00592588-06?
You can request a quote for AB00592588-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00592588-06?
Yes, KEHONG BIO provides custom synthesis services for AB00592588-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.