11M-588S
TL;DR: 11M-588S (CAS 477854-87-8) is a chemical compound with molecular formula C19H10ClF6N3O2 and molecular weight 461.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-6-oxo-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
Also Known As: 11M-588S, 1-(4-chlorophenyl)-6-oxo-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide, 1-(4-chlorophenyl)-6-oxo-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]-1,6-dihydro-3-pyridazinecarboxamide, 1-(4-chlorophenyl)-6-oxo-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]-1,6-dihydropyridazine-3-carboxamide
| Molecular Formula | C19H10ClF6N3O2 |
|---|---|
| Molecular Weight | 461.04 g/mol |
| LogP | 5.1758 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 461.03656 |
| Heavy Atoms | 31 |
| Complexity | 1186.9731 |
Chemical Identifiers
| CAS Number | 477854-87-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)C2=NN(C(=O)C=C2C(F)(F)F)C3=CC=C(C=C3)Cl)C(F)(F)F |
Product Overview
11M-588S (CAS 477854-87-8), with molecular formula C19H10ClF6N3O2 and molecular weight 461.04 g/mol. IUPAC: 1-(4-chlorophenyl)-6-oxo-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide.
Chemical Property Profile of 11M-588S
Property Insights of 11M-588S
The XLogP value of 5.1758 indicates that 11M-588S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 11M-588S. Following Lipinski's Rule of Five, 11M-588S has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11M-588S?
The CAS number of 11M-588S is 477854-87-8.
What is the molecular formula of 11M-588S?
The molecular formula of 11M-588S is C19H10ClF6N3O2.
What is the molecular weight of 11M-588S?
The molecular weight of 11M-588S is 461.04 g/mol.
Where can I buy 11M-588S?
You can request a quote for 11M-588S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11M-588S?
Yes, KEHONG BIO provides custom synthesis services for 11M-588S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.