J2.447.028H
TL;DR: J2.447.028H (CAS 61052-99-1) is a chemical compound with molecular formula C18H16N2O8 and molecular weight 388.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(3-carboxypropyl)-1,3,5,7-tetraoxopyrrolo[3,4-f]isoindol-6-yl]butanoic acid
Also Known As: J2.447.028H, 1,3,5,7-Tetrahydro-1,3,5,7-tetraoxobenzo[1,2-c:4,5-c ]dipyrrole-2,6-dibutyric acid, 4,4'-(1,3,5,7-tetraoxo-5,7-dihydropyrrolo[3,4-f]isoindole-2,6-diyl)dibutanoic acid, 4,4'-(1,3,5,7-tetraoxopyrrolo[3,4-f]isoindole-2,6(1H,3H,5H,7H)-diyl)dibutanoic acid, 4-[2-(4-hydroxy-4-oxobutyl)-1,3,5,7-tetraoxopyrrolo[3,4-f]isoindol-6-yl]butanoic acid
| Molecular Formula | C18H16N2O8 |
|---|---|
| Molecular Weight | 388.09 g/mol |
| LogP | -0.358 |
| Topological Polar Surface Area | 152.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 388.09067 |
| Heavy Atoms | 28 |
| Complexity | 1127.2639 |
Chemical Identifiers
| CAS Number | 61052-99-1 |
|---|---|
| SMILES | C1=C2C(=CC3=C1C(=O)N(C3=O)CCCC(=O)O)C(=O)N(C2=O)CCCC(=O)O |
Product Overview
J2.447.028H (CAS 61052-99-1), with molecular formula C18H16N2O8 and molecular weight 388.09 g/mol. IUPAC: 4-[2-(3-carboxypropyl)-1,3,5,7-tetraoxopyrrolo[3,4-f]isoindol-6-yl]butanoic acid.
Chemical Property Profile of J2.447.028H
Property Insights of J2.447.028H
The XLogP value of -0.358 indicates that J2.447.028H is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 152.74 Ų indicates high polarity, suggesting J2.447.028H may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, J2.447.028H has 2 hydrogen bond donor(s) and 6 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 J2.447.028H?
The CAS number of J2.447.028H is 61052-99-1.
What is the molecular formula of J2.447.028H?
The molecular formula of J2.447.028H is C18H16N2O8.
What is the molecular weight of J2.447.028H?
The molecular weight of J2.447.028H is 388.09 g/mol.
Where can I buy J2.447.028H?
You can request a quote for J2.447.028H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J2.447.028H?
Yes, KEHONG BIO provides custom synthesis services for J2.447.028H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.