Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-
TL;DR: Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)- (CAS 64868-74-2) is a chemical compound with molecular formula C6H8N4O3 and molecular weight 184.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-(1,2,4-triazol-4-ylamino)butanoic acid
Also Known As: SALOR-INT L496693-1EA, LABOTEST-BB LT00112007, 4-oxo-4-(1,2,4-triazol-4-ylamino)butanoic acid, Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-, 3-(1,2,4-triazol-4-ylcarbamoyl)propanoic Acid
| Molecular Formula | C6H8N4O3 |
|---|---|
| Molecular Weight | 184.06 g/mol |
| LogP | -0.787 |
| Topological Polar Surface Area | 97.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 184.05965 |
| Heavy Atoms | 13 |
| Complexity | 294.83783 |
Chemical Identifiers
| CAS Number | 64868-74-2 |
|---|---|
| SMILES | C1=NN=CN1NC(=O)CCC(=O)O |
Product Overview
Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)- (CAS 64868-74-2), with molecular formula C6H8N4O3 and molecular weight 184.06 g/mol. IUPAC: 4-oxo-4-(1,2,4-triazol-4-ylamino)butanoic acid.
Chemical Property Profile of Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-
Property Insights of Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-
The XLogP value of -0.787 indicates that Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-. Following Lipinski's Rule of Five, Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)- 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 Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-?
The CAS number of Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)- is 64868-74-2.
What is the molecular formula of Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-?
The molecular formula of Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)- is C6H8N4O3.
What is the molecular weight of Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-?
The molecular weight of Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)- is 184.06 g/mol.
Where can I buy Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-?
You can request a quote for Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)-?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 4-oxo-4-(4H-1,2,4-triazol-4-ylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.