L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester
TL;DR: L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester (CAS 98166-00-8) is a chemical compound with molecular formula C18H23N3O3 and molecular weight 329.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[(2-phenylacetyl)-(1,3,5-trimethylpyrazol-4-yl)amino]propanoate
Also Known As: L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester, Methyl (2S)-2-((2-phenylacetyl)-(1,3,5-trimethylpyrazol-4-yl)amino)propanoate, Methyl (2S)-2-[(2-phenylacetyl)-(1,3,5-trimethylpyrazol-4-yl)amino]propanoate, Methyl N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-L-alaninate
| Molecular Formula | C18H23N3O3 |
|---|---|
| Molecular Weight | 329.17 g/mol |
| LogP | 2.17414 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.17395 |
| Heavy Atoms | 24 |
| Complexity | 737.4673 |
Chemical Identifiers
| CAS Number | 98166-00-8 |
|---|---|
| SMILES | CC1=C(C(=NN1C)C)N([C@@H](C)C(=O)OC)C(=O)CC2=CC=CC=C2 |
Product Overview
L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester (CAS 98166-00-8), with molecular formula C18H23N3O3 and molecular weight 329.17 g/mol. IUPAC: methyl (2S)-2-[(2-phenylacetyl)-(1,3,5-trimethylpyrazol-4-yl)amino]propanoate.
Chemical Property Profile of L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester
Property Insights of L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester
The XLogP value of 2.17414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester. The TPSA of 64.43 Ų falls within the moderate polarity range, balancing permeability and solubility for L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester. Following Lipinski's Rule of Five, L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester has 0 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 L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester?
The CAS number of L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester is 98166-00-8.
What is the molecular formula of L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester?
The molecular formula of L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester is C18H23N3O3.
What is the molecular weight of L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester?
The molecular weight of L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester is 329.17 g/mol.
Where can I buy L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester?
You can request a quote for L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for L-Alanine, N-(phenylacetyl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.