![3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione structure](/static/products/102/1024050-30-3.png)
3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione
TL;DR: 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione (CAS 1024050-30-3) is a chemical compound with molecular formula C24H18N4O5 and molecular weight 442.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-methoxyphenyl)-3-(4-nitrophenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione
Also Known As: 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione, 5-(2-methoxyphenyl)-3-(4-nitrophenyl)-1-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione, 5-(2-methoxyphenyl)-3-(4-nitrophenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione, 5-(2-methoxyphenyl)-3-(4-nitrophenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione
| Molecular Formula | C24H18N4O5 |
|---|---|
| Molecular Weight | 442.13 g/mol |
| LogP | 3.3859 |
| Topological Polar Surface Area | 105.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.12772 |
| Heavy Atoms | 33 |
| Complexity | 1289.7214 |
Chemical Identifiers
| CAS Number | 1024050-30-3 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C(=O)C3C(C2=O)N(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5 |
Product Overview
3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione (CAS 1024050-30-3), with molecular formula C24H18N4O5 and molecular weight 442.13 g/mol. IUPAC: 5-(2-methoxyphenyl)-3-(4-nitrophenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione.
Chemical Property Profile of 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione
Property Insights of 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione
The XLogP value of 3.3859 indicates that 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione. Following Lipinski's Rule of Five, 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione has 0 hydrogen bond donor(s) and 7 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 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione?
The CAS number of 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione is 1024050-30-3.
What is the molecular formula of 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione?
The molecular formula of 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione is C24H18N4O5.
What is the molecular weight of 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione?
The molecular weight of 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione is 442.13 g/mol.
Where can I buy 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione?
You can request a quote for 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-methoxyphenyl)-8-(4-nitrophenyl)-6-phenyl-3,6,7-triazabicyclo[3.3.0]oct-7-ene-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.