![(2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate structure](/static/products/306/3061-95-8.png)
(2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate
TL;DR: (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate (CAS 3061-95-8) is a chemical compound with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate
Also Known As: (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | -1.9058 |
| Topological Polar Surface Area | 96.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 389.99704 |
Chemical Identifiers
| CAS Number | 3061-95-8 |
|---|---|
| SMILES | C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)[O-])[NH3+] |
Product Overview
(2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate (CAS 3061-95-8), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate.
Chemical Property Profile of (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate
Property Insights of (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate
The XLogP value of -1.9058 indicates that (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 96.87 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate. Following Lipinski's Rule of Five, (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate has 2 hydrogen bond donor(s) and 3 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-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate?
The CAS number of (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate is 3061-95-8.
What is the molecular formula of (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate?
The molecular formula of (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate is C12H16N2O3.
What is the molecular weight of (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate?
The molecular weight of (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate is 236.12 g/mol.
Where can I buy (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate?
You can request a quote for (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-[[(2R)-2-azaniumylpropanoyl]amino]-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.