F1601-0085
TL;DR: F1601-0085 (CAS 865655-51-2) is a chemical compound with molecular formula C26H27N3O5S and molecular weight 493.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-ethoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]-N-(furan-2-ylmethyl)acetamide
Also Known As: F1601-0085, 2-[3-(4-ethoxyphenyl)-2,4-dioxo-3,4,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-(2-furylmethyl)acetamide, 2-[4-(4-ethoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.0^{2,7}]tetradeca-1(9),2(7)-dien-6-yl]-N-[(furan-2-yl)methyl]acetamide, 2-(3-(4-ethoxyphenyl)-2,4-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1-yl)-N-(furan-2-ylmethyl)acetamide, 2-[4-(4-ethoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]-N-(furan-2-ylmethyl)acetamide
| Molecular Formula | C26H27N3O5S |
|---|---|
| Molecular Weight | 493.17 g/mol |
| LogP | 3.7909 |
| Topological Polar Surface Area | 95.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 493.16714 |
| Heavy Atoms | 35 |
| Complexity | 1462.1576 |
Chemical Identifiers
| CAS Number | 865655-51-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3=C(N(C2=O)CC(=O)NCC4=CC=CO4)SC5=C3CCCCC5 |
Product Overview
F1601-0085 (CAS 865655-51-2), with molecular formula C26H27N3O5S and molecular weight 493.17 g/mol. IUPAC: 2-[4-(4-ethoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]-N-(furan-2-ylmethyl)acetamide.
Chemical Property Profile of F1601-0085
Property Insights of F1601-0085
The XLogP value of 3.7909 indicates that F1601-0085 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.47 Ų falls within the moderate polarity range, balancing permeability and solubility for F1601-0085. Following Lipinski's Rule of Five, F1601-0085 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 F1601-0085?
The CAS number of F1601-0085 is 865655-51-2.
What is the molecular formula of F1601-0085?
The molecular formula of F1601-0085 is C26H27N3O5S.
What is the molecular weight of F1601-0085?
The molecular weight of F1601-0085 is 493.17 g/mol.
Where can I buy F1601-0085?
You can request a quote for F1601-0085 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1601-0085?
Yes, KEHONG BIO provides custom synthesis services for F1601-0085 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.