2,4-二氧代-4-(4-吡啶基)丁酸
TL;DR: 2,4-二氧代-4-(4-吡啶基)丁酸 (CAS 98589-58-3) is a chemical compound with molecular formula C9H7NO4 and molecular weight 193.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-二氧代-4-(4-吡啶基)丁酸
2,4-dioxo-4-pyridin-4-ylbutanoic acid
Also Known As: 2,4-dioxo-4-pyridin-4-ylbutanoic acid, 2,4-dioxo-4-(pyridin-4-yl)butanoic acid, DIETHANOLAMINESULFATE, 4-Pyridinebutanoicacid, a,g-dioxo-, 2,4-dioxo-4-(4-pyridyl)butanoic acid
| Molecular Formula | C9H7NO4 |
|---|---|
| Molecular Weight | 193.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 84.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.0375 |
| Heavy Atoms | 14 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 98589-58-3 |
|---|---|
| SMILES | C1=CN=CC=C1C(=O)CC(=O)C(=O)O |
| InChIKey | ROQQLNHLFCKPOQ-UHFFFAOYSA-N |
Product Overview
2,4-二氧代-4-(4-吡啶基)丁酸 (CAS 98589-58-3), with molecular formula C9H7NO4 and molecular weight 193.04 g/mol. IUPAC: 2,4-dioxo-4-pyridin-4-ylbutanoic acid.
Chemical Property Profile of 2,4-二氧代-4-(4-吡啶基)丁酸
Property Insights of 2,4-二氧代-4-(4-吡啶基)丁酸
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-二氧代-4-(4-吡啶基)丁酸. The TPSA of 84.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-二氧代-4-(4-吡啶基)丁酸. Following Lipinski's Rule of Five, 2,4-二氧代-4-(4-吡啶基)丁酸 has 1 hydrogen bond donor(s) and 5 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 2,4-二氧代-4-(4-吡啶基)丁酸?
The CAS number of 2,4-二氧代-4-(4-吡啶基)丁酸 is 98589-58-3.
What is the molecular formula of 2,4-二氧代-4-(4-吡啶基)丁酸?
The molecular formula of 2,4-二氧代-4-(4-吡啶基)丁酸 is C9H7NO4.
What is the molecular weight of 2,4-二氧代-4-(4-吡啶基)丁酸?
The molecular weight of 2,4-二氧代-4-(4-吡啶基)丁酸 is 193.04 g/mol.
Where can I buy 2,4-二氧代-4-(4-吡啶基)丁酸?
You can request a quote for 2,4-二氧代-4-(4-吡啶基)丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-二氧代-4-(4-吡啶基)丁酸?
Yes, KEHONG BIO provides custom synthesis services for 2,4-二氧代-4-(4-吡啶基)丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.