AB00686257-01
TL;DR: AB00686257-01 (CAS 866894-94-2) is a chemical compound with molecular formula C25H27N3O4S and molecular weight 465.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(3-ethoxypropyl)-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(2-ethylphenyl)acetamide
Also Known As: AB00686257-01, F1607-0501, 2-{[3-(3-ethoxypropyl)-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(2-ethylphenyl)acetamide, 2-{[5-(3-ethoxypropyl)-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-(2-ethylphenyl)acetamide, 2-[[3-(3-ethoxypropyl)-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(2-ethylphenyl)acetamide
| Molecular Formula | C25H27N3O4S |
|---|---|
| Molecular Weight | 465.17 g/mol |
| LogP | 4.8625 |
| Topological Polar Surface Area | 86.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 465.17224 |
| Heavy Atoms | 33 |
| Complexity | 1328.479 |
Chemical Identifiers
| CAS Number | 866894-94-2 |
|---|---|
| SMILES | CCC1=CC=CC=C1NC(=O)CSC2=NC3=C(C(=O)N2CCCOCC)OC4=CC=CC=C43 |
Product Overview
AB00686257-01 (CAS 866894-94-2), with molecular formula C25H27N3O4S and molecular weight 465.17 g/mol. IUPAC: 2-[[3-(3-ethoxypropyl)-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(2-ethylphenyl)acetamide.
Chemical Property Profile of AB00686257-01
Property Insights of AB00686257-01
The XLogP value of 4.8625 indicates that AB00686257-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.36 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00686257-01. Following Lipinski's Rule of Five, AB00686257-01 has 1 hydrogen bond donor(s) and 6 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 AB00686257-01?
The CAS number of AB00686257-01 is 866894-94-2.
What is the molecular formula of AB00686257-01?
The molecular formula of AB00686257-01 is C25H27N3O4S.
What is the molecular weight of AB00686257-01?
The molecular weight of AB00686257-01 is 465.17 g/mol.
Where can I buy AB00686257-01?
You can request a quote for AB00686257-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00686257-01?
Yes, KEHONG BIO provides custom synthesis services for AB00686257-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.