AB00645260-05
TL;DR: AB00645260-05 (CAS 958944-06-4) is a chemical compound with molecular formula C22H16N4O6 and molecular weight 432.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[5-(3-methoxyphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-2-oxoethyl]isoindole-1,3-dione
Also Known As: AB00645260-05, 2-(2-(5-(3-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazol-3-yl)-2-oxoethyl)isoindoline-1,3-dione, 2-[2-[5-(3-methoxyphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-2-oxoethyl]isoindole-1,3-dione, 2-{2-[5-(3-Methoxy-phenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydro-pyrrolo[3,4-c]pyrazol-3-yl]-2-oxo-ethyl}-is oindole-1,3-dione
| Molecular Formula | C22H16N4O6 |
|---|---|
| Molecular Weight | 432.11 g/mol |
| LogP | 0.3777 |
| Topological Polar Surface Area | 125.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.107 |
| Heavy Atoms | 32 |
| Complexity | 1217.487 |
Chemical Identifiers
| CAS Number | 958944-06-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1)N2C(=O)C3C(C2=O)NN=C3C(=O)CN4C(=O)C5=CC=CC=C5C4=O |
Product Overview
AB00645260-05 (CAS 958944-06-4), with molecular formula C22H16N4O6 and molecular weight 432.11 g/mol. IUPAC: 2-[2-[5-(3-methoxyphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-2-oxoethyl]isoindole-1,3-dione.
Chemical Property Profile of AB00645260-05
Property Insights of AB00645260-05
The XLogP value of 0.3777 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00645260-05. The TPSA of 125.45 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00645260-05. Following Lipinski's Rule of Five, AB00645260-05 has 1 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 AB00645260-05?
The CAS number of AB00645260-05 is 958944-06-4.
What is the molecular formula of AB00645260-05?
The molecular formula of AB00645260-05 is C22H16N4O6.
What is the molecular weight of AB00645260-05?
The molecular weight of AB00645260-05 is 432.11 g/mol.
Where can I buy AB00645260-05?
You can request a quote for AB00645260-05 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00645260-05?
Yes, KEHONG BIO provides custom synthesis services for AB00645260-05 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.