异烟酰基γ-氨基丁酸
TL;DR: 异烟酰基γ-氨基丁酸 (CAS 67036-49-1) is a chemical compound with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异烟酰基γ-氨基丁酸
4-(pyridine-4-carbonylamino)butanoic acid
Also Known As: Isonicotinylamide GABA, Isonicotinoyl Gaba, GABA isonicotinoylamide, GABA-IG, Isonicotinoylamide GABA
| Molecular Formula | C10H12N2O3 |
|---|---|
| Molecular Weight | 208.08 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 79.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 208.0848 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 67036-49-1 |
|---|---|
| SMILES | C1=CN=CC=C1C(=O)NCCCC(=O)O |
| InChIKey | CZOQVDHADMADNN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异烟酰基γ-氨基丁酸 (CAS 67036-49-1), with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol. IUPAC: 4-(pyridine-4-carbonylamino)butanoic acid.
Chemical Property Profile of 异烟酰基γ-氨基丁酸
Property Insights of 异烟酰基γ-氨基丁酸
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 异烟酰基γ-氨基丁酸. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 异烟酰基γ-氨基丁酸. Following Lipinski's Rule of Five, 异烟酰基γ-氨基丁酸 has 2 hydrogen bond donor(s) and 4 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 异烟酰基γ-氨基丁酸?
The CAS number of 异烟酰基γ-氨基丁酸 is 67036-49-1.
What is the molecular formula of 异烟酰基γ-氨基丁酸?
The molecular formula of 异烟酰基γ-氨基丁酸 is C10H12N2O3.
What is the molecular weight of 异烟酰基γ-氨基丁酸?
The molecular weight of 异烟酰基γ-氨基丁酸 is 208.08 g/mol.
Where can I buy 异烟酰基γ-氨基丁酸?
You can request a quote for 异烟酰基γ-氨基丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异烟酰基γ-氨基丁酸?
Yes, KEHONG BIO provides custom synthesis services for 异烟酰基γ-氨基丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.