F0579-0736
TL;DR: F0579-0736 (CAS 862806-56-2) is a chemical compound with molecular formula C21H15BrN4O2S3 and molecular weight 529.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-2-[[3-(4-bromophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: F0579-0736, N-(1,3-benzothiazol-2-yl)-2-{[3-(4-bromophenyl)-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide, N-(1,3-benzothiazol-2-yl)-2-[[3-(4-bromophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide, N-(1,3-benzothiazol-2-yl)-2-{[3-(4-bromophenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide, N-(benzo[d]thiazol-2-yl)-2-((3-(4-bromophenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)acetamide
| Molecular Formula | C21H15BrN4O2S3 |
|---|---|
| Molecular Weight | 529.95 g/mol |
| LogP | 4.9837 |
| Topological Polar Surface Area | 76.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 529.95404 |
| Heavy Atoms | 31 |
| Complexity | 1318.2463 |
Chemical Identifiers
| CAS Number | 862806-56-2 |
|---|---|
| SMILES | C1CSC2=C1N=C(N(C2=O)C3=CC=C(C=C3)Br)SCC(=O)NC4=NC5=CC=CC=C5S4 |
Product Overview
F0579-0736 (CAS 862806-56-2), with molecular formula C21H15BrN4O2S3 and molecular weight 529.95 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-2-[[3-(4-bromophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of F0579-0736
Property Insights of F0579-0736
The XLogP value of 4.9837 indicates that F0579-0736 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.88 Ų falls within the moderate polarity range, balancing permeability and solubility for F0579-0736. Following Lipinski's Rule of Five, F0579-0736 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 F0579-0736?
The CAS number of F0579-0736 is 862806-56-2.
What is the molecular formula of F0579-0736?
The molecular formula of F0579-0736 is C21H15BrN4O2S3.
What is the molecular weight of F0579-0736?
The molecular weight of F0579-0736 is 529.95 g/mol.
Where can I buy F0579-0736?
You can request a quote for F0579-0736 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0579-0736?
Yes, KEHONG BIO provides custom synthesis services for F0579-0736 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.