![3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione structure](/static/products/958/958944-01-9.png)
3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione
TL;DR: 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione (CAS 958944-01-9) is a chemical compound with molecular formula C25H18BrN3O4 and molecular weight 503.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzoyl-5-(4-bromophenyl)-1-(2-methoxyphenyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione
Also Known As: 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione, 3-benzoyl-5-(4-bromophenyl)-1-(2-methoxyphenyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione, 3-benzoyl-5-(4-bromophenyl)-1-(2-methoxyphenyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione, 5-(4-bromophenyl)-1-(2-methoxyphenyl)-3-(phenylcarbonyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione, 6-benzoyl-3-(4-bromophenyl)-8-(2-methoxyphenyl)-3,7,8-triazabicyclo[3.3.0]oct-6-ene-2,4-dione
| Molecular Formula | C25H18BrN3O4 |
|---|---|
| Molecular Weight | 503.05 g/mol |
| LogP | 4.0748 |
| Topological Polar Surface Area | 79.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 503.04807 |
| Heavy Atoms | 33 |
| Complexity | 1290.5189 |
Chemical Identifiers
| CAS Number | 958944-01-9 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C3C(C(=N2)C(=O)C4=CC=CC=C4)C(=O)N(C3=O)C5=CC=C(C=C5)Br |
Product Overview
3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione (CAS 958944-01-9), with molecular formula C25H18BrN3O4 and molecular weight 503.05 g/mol. IUPAC: 3-benzoyl-5-(4-bromophenyl)-1-(2-methoxyphenyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione.
Chemical Property Profile of 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione
Property Insights of 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione
The XLogP value of 4.0748 indicates that 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione. Following Lipinski's Rule of Five, 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione?
The CAS number of 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione is 958944-01-9.
What is the molecular formula of 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione?
The molecular formula of 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione is C25H18BrN3O4.
What is the molecular weight of 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione?
The molecular weight of 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione is 503.05 g/mol.
Where can I buy 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione?
You can request a quote for 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzoyl-5-(4-bromo-phenyl)-1-(2-methoxy-phenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.