F1601-0086
TL;DR: F1601-0086 (CAS 865655-52-3) is a chemical compound with molecular formula C28H26N4O4S and molecular weight 514.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-ethoxyphenyl)-6-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-diene-3,5-dione
Also Known As: F1601-0086, 3-(4-ethoxyphenyl)-1-((4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl)-6,7,8,9-tetrahydro-1H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H,5H)-dione, 4-(4-ethoxyphenyl)-6-({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)-8-thia-4,6-diazatricyclo[7.5.0.0^{2,7}]tetradeca-1(9),2(7)-diene-3,5-dione, 3-(4-ethoxyphenyl)-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione, 4-(4-ethoxyphenyl)-6-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-diene-3,5-dione
| Molecular Formula | C28H26N4O4S |
|---|---|
| Molecular Weight | 514.17 g/mol |
| LogP | 3.9377 |
| Topological Polar Surface Area | 87.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 514.1675 |
| Heavy Atoms | 37 |
| Complexity | 1811.6356 |
Chemical Identifiers
| CAS Number | 865655-52-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3=C(N(C2=O)CC4=CC(=O)N5C=CC=CC5=N4)SC6=C3CCCCC6 |
Product Overview
F1601-0086 (CAS 865655-52-3), with molecular formula C28H26N4O4S and molecular weight 514.17 g/mol. IUPAC: 4-(4-ethoxyphenyl)-6-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-diene-3,5-dione.
Chemical Property Profile of F1601-0086
Property Insights of F1601-0086
The XLogP value of 3.9377 indicates that F1601-0086 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.6 Ų falls within the moderate polarity range, balancing permeability and solubility for F1601-0086. Following Lipinski's Rule of Five, F1601-0086 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1601-0086?
The CAS number of F1601-0086 is 865655-52-3.
What is the molecular formula of F1601-0086?
The molecular formula of F1601-0086 is C28H26N4O4S.
What is the molecular weight of F1601-0086?
The molecular weight of F1601-0086 is 514.17 g/mol.
Where can I buy F1601-0086?
You can request a quote for F1601-0086 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1601-0086?
Yes, KEHONG BIO provides custom synthesis services for F1601-0086 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.