BIM-0041269.P001
TL;DR: BIM-0041269.P001 (CAS 425392-35-4) is a chemical compound with molecular formula C18H16BrN3O4S and molecular weight 449.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4Z)-4-[(3-bromo-4-methoxyphenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonamide
Also Known As: BIM-0041269.P001, AN-989/40821644, 4-[(4Z)-4-[(3-bromo-4-methoxyphenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonamide, 4-[4-(3-bromo-4-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzenesulfonamide
| Molecular Formula | C18H16BrN3O4S |
|---|---|
| Molecular Weight | 449.00 g/mol |
| LogP | 2.9112 |
| Topological Polar Surface Area | 102.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 449.0045 |
| Heavy Atoms | 27 |
| Complexity | 1076.2856 |
Chemical Identifiers
| CAS Number | 425392-35-4 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C\C2=CC(=C(C=C2)OC)Br)C3=CC=C(C=C3)S(=O)(=O)N |
Product Overview
BIM-0041269.P001 (CAS 425392-35-4), with molecular formula C18H16BrN3O4S and molecular weight 449.00 g/mol. IUPAC: 4-[(4Z)-4-[(3-bromo-4-methoxyphenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonamide.
Chemical Property Profile of BIM-0041269.P001
Property Insights of BIM-0041269.P001
The XLogP value of 2.9112 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0041269.P001. The TPSA of 102.06 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0041269.P001. Following Lipinski's Rule of Five, BIM-0041269.P001 has 1 hydrogen bond donor(s) and 5 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 BIM-0041269.P001?
The CAS number of BIM-0041269.P001 is 425392-35-4.
What is the molecular formula of BIM-0041269.P001?
The molecular formula of BIM-0041269.P001 is C18H16BrN3O4S.
What is the molecular weight of BIM-0041269.P001?
The molecular weight of BIM-0041269.P001 is 449.00 g/mol.
Where can I buy BIM-0041269.P001?
You can request a quote for BIM-0041269.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0041269.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0041269.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.