AN-465/40934331
TL;DR: AN-465/40934331 (CAS 433328-72-4) is a chemical compound with molecular formula C18H13F3N4O7S and molecular weight 486.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4Z)-4-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-5-oxo-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
Also Known As: AN-465/40934331, 4-[4-[(E)-(3-methoxy-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-3-oxo-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide, 4-[4-{4-hydroxy-3-nitro-5-methoxybenzylidene}-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzenesulfonamide, (Z)-4-(4-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonamide, 4-[(4Z)-4-[(4-HYDROXY-3-METHOXY-5-NITROPHENYL)METHYLIDENE]-5-OXO-3-(TRIFLUOROMETHYL)PYRAZOL-1-YL]BENZENESULFONAMIDE
| Molecular Formula | C18H13F3N4O7S |
|---|---|
| Molecular Weight | 486.05 g/mol |
| LogP | 2.3049 |
| Topological Polar Surface Area | 165.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.04572 |
| Heavy Atoms | 33 |
| Complexity | 1319.784 |
Chemical Identifiers
| CAS Number | 433328-72-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C\2/C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F |
Product Overview
AN-465/40934331 (CAS 433328-72-4), with molecular formula C18H13F3N4O7S and molecular weight 486.05 g/mol. IUPAC: 4-[(4Z)-4-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-5-oxo-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide.
Chemical Property Profile of AN-465/40934331
Property Insights of AN-465/40934331
The XLogP value of 2.3049 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-465/40934331. The TPSA of 165.43 Ų indicates high polarity, suggesting AN-465/40934331 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AN-465/40934331 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-465/40934331?
The CAS number of AN-465/40934331 is 433328-72-4.
What is the molecular formula of AN-465/40934331?
The molecular formula of AN-465/40934331 is C18H13F3N4O7S.
What is the molecular weight of AN-465/40934331?
The molecular weight of AN-465/40934331 is 486.05 g/mol.
Where can I buy AN-465/40934331?
You can request a quote for AN-465/40934331 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/40934331?
Yes, KEHONG BIO provides custom synthesis services for AN-465/40934331 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.