![4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium structure](/static/products/7232/7232-18-0.webp)
4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium
TL;DR: 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium (CAS 7232-18-0) is a chemical compound with molecular formula C10H18N3O3+ and molecular weight 228.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-oxo-3,3a,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-d]imidazol-5-ium-4-yl)pentanoic acid
Also Known As: 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium, 5-(7-oxo-6,8-diaza-3-azoniabicyclo[3.3.0]oct-2-yl)pentanoic Acid, 5-(2-oxo-3,3a,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-d]imidazol-5-ium-4-yl)pentanoic acid
| Molecular Formula | C10H18N3O3+ |
|---|---|
| Molecular Weight | 228.13 g/mol |
| LogP | -1.373 |
| Topological Polar Surface Area | 95.04 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 228.13481 |
| Heavy Atoms | 16 |
| Complexity | 295.03384 |
Chemical Identifiers
| CAS Number | 7232-18-0 |
|---|---|
| SMILES | C1C2C(C([NH2+]1)CCCCC(=O)O)NC(=O)N2 |
Product Overview
4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium (CAS 7232-18-0), with molecular formula C10H18N3O3+ and molecular weight 228.13 g/mol. IUPAC: 5-(2-oxo-3,3a,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-d]imidazol-5-ium-4-yl)pentanoic acid.
Chemical Property Profile of 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium
Property Insights of 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium
The XLogP value of -1.373 indicates that 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium. Following Lipinski's Rule of Five, 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium has 4 hydrogen bond donor(s) and 2 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 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium?
The CAS number of 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium is 7232-18-0.
What is the molecular formula of 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium?
The molecular formula of 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium is C10H18N3O3+.
What is the molecular weight of 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium?
The molecular weight of 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium is 228.13 g/mol.
Where can I buy 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium?
You can request a quote for 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Carboxybutyl)-2-oxooctahydropyrrolo[3,4-d]imidazol-5-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.