(2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid
TL;DR: (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid (CAS 98166-06-4) is a chemical compound with molecular formula C9H15N3O2 and molecular weight 197.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(1,3,5-trimethylpyrazol-4-yl)amino]propanoic acid
Also Known As: N-(1,3,5-Trimethyl-1H-pyrazol-4-yl)alanine, (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid, L-Alanine, N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-L-alanine, (2S)-2-[(1,3,5-trimethylpyrazol-4-yl)amino]propanoic Acid
| Molecular Formula | C9H15N3O2 |
|---|---|
| Molecular Weight | 197.12 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.11642 |
| Heavy Atoms | 14 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 98166-06-4 |
|---|---|
| SMILES | CC1=C(C(=NN1C)C)N[C@@H](C)C(=O)O |
| InChIKey | DUIJZZQKCXIQSH-LURJTMIESA-N |
Product Overview
(2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid (CAS 98166-06-4), with molecular formula C9H15N3O2 and molecular weight 197.12 g/mol. IUPAC: (2S)-2-[(1,3,5-trimethylpyrazol-4-yl)amino]propanoic acid.
Chemical Property Profile of (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid
Property Insights of (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid. Following Lipinski's Rule of Five, (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid 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 (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid?
The CAS number of (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid is 98166-06-4.
What is the molecular formula of (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid?
The molecular formula of (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid is C9H15N3O2.
What is the molecular weight of (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid?
The molecular weight of (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid is 197.12 g/mol.
Where can I buy (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid?
You can request a quote for (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-((1,3,5-Trimethylpyrazol-4-yl)amino)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.