F0641-0630
TL;DR: F0641-0630 (CAS 6258-11-3) is a chemical compound with molecular formula C21H13BrF3N3O5S and molecular weight 554.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(5-bromofuran-2-carbonyl)amino]-4-oxo-3-[4-(trifluoromethyl)phenyl]thieno[3,4-d]pyridazine-1-carboxylate
Also Known As: F0641-0630, Ethyl 5-[(5-bromofuran-2-carbonyl)amino]-4-oxo-3-[4-(trifluoromethyl)phenyl]-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate, ethyl 5-(5-bromofuran-2-carboxamido)-4-oxo-3-(4-(trifluoromethyl)phenyl)-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate, Ethyl 5-(5-bromofuran-2-carboxamido)-4-oxo-3-[4-(trifluoromethyl)phenyl]-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate, ethyl 5-[(5-bromofuran-2-carbonyl)amino]-4-oxo-3-[4-(trifluoromethyl)phenyl]thieno[3,4-d]pyridazine-1-carboxylate
| Molecular Formula | C21H13BrF3N3O5S |
|---|---|
| Molecular Weight | 554.97 g/mol |
| LogP | 5.2505 |
| Topological Polar Surface Area | 103.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 554.9711 |
| Heavy Atoms | 34 |
| Complexity | 1457.3306 |
Chemical Identifiers
| CAS Number | 6258-11-3 |
|---|---|
| SMILES | CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)C3=CC=C(O3)Br)C4=CC=C(C=C4)C(F)(F)F |
Product Overview
F0641-0630 (CAS 6258-11-3), with molecular formula C21H13BrF3N3O5S and molecular weight 554.97 g/mol. IUPAC: ethyl 5-[(5-bromofuran-2-carbonyl)amino]-4-oxo-3-[4-(trifluoromethyl)phenyl]thieno[3,4-d]pyridazine-1-carboxylate.
Chemical Property Profile of F0641-0630
Property Insights of F0641-0630
The XLogP value of 5.2505 indicates that F0641-0630 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.43 Ų falls within the moderate polarity range, balancing permeability and solubility for F0641-0630. Following Lipinski's Rule of Five, F0641-0630 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 F0641-0630?
The CAS number of F0641-0630 is 6258-11-3.
What is the molecular formula of F0641-0630?
The molecular formula of F0641-0630 is C21H13BrF3N3O5S.
What is the molecular weight of F0641-0630?
The molecular weight of F0641-0630 is 554.97 g/mol.
Where can I buy F0641-0630?
You can request a quote for F0641-0630 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0641-0630?
Yes, KEHONG BIO provides custom synthesis services for F0641-0630 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.