F0913-3955
TL;DR: F0913-3955 (CAS 422299-88-5) is a chemical compound with molecular formula C28H23FN4O3S3 and molecular weight 578.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-[[3-(4-ethoxyphenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetamide
Also Known As: F0913-3955, N-benzyl-2-{[3-(4-ethoxyphenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide, N-benzyl-2-((3-(4-ethoxyphenyl)-6-(4-fluorophenyl)-7-oxo-2-thioxo-2,3,6,7-tetrahydrothiazolo[4,5-d]pyrimidin-5-yl)thio)acetamide, N-benzyl-2-[[3-(4-ethoxyphenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetamide
| Molecular Formula | C28H23FN4O3S3 |
|---|---|
| Molecular Weight | 578.09 g/mol |
| LogP | 5.91369 |
| Topological Polar Surface Area | 78.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 578.0916 |
| Heavy Atoms | 39 |
| Complexity | 1731.5109 |
Chemical Identifiers
| CAS Number | 422299-88-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C3=C(C(=O)N(C(=N3)SCC(=O)NCC4=CC=CC=C4)C5=CC=C(C=C5)F)SC2=S |
Product Overview
F0913-3955 (CAS 422299-88-5), with molecular formula C28H23FN4O3S3 and molecular weight 578.09 g/mol. IUPAC: N-benzyl-2-[[3-(4-ethoxyphenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetamide.
Chemical Property Profile of F0913-3955
Property Insights of F0913-3955
The XLogP value of 5.91369 indicates that F0913-3955 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.15 Ų falls within the moderate polarity range, balancing permeability and solubility for F0913-3955. Following Lipinski's Rule of Five, F0913-3955 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0913-3955?
The CAS number of F0913-3955 is 422299-88-5.
What is the molecular formula of F0913-3955?
The molecular formula of F0913-3955 is C28H23FN4O3S3.
What is the molecular weight of F0913-3955?
The molecular weight of F0913-3955 is 578.09 g/mol.
Where can I buy F0913-3955?
You can request a quote for F0913-3955 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0913-3955?
Yes, KEHONG BIO provides custom synthesis services for F0913-3955 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.