(2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride
TL;DR: (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride (CAS 312693-79-1) is a chemical compound with molecular formula C18H28Cl2N4O5 and molecular weight 450.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((2S)-2-amino-3-(4-aminophenyl)propanoic acid);hydrate;dihydrochloride
Also Known As: 4-Amino-L-phenylalanine hydrochloride, p-Amino-L-Phenylalanine Hydrochloride Hemihydrate, (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride, (2S)-2-amino-3-(4-aminophenyl)propanoic Acid Hydrate Dihydrochloride
| Molecular Formula | C18H28Cl2N4O5 |
|---|---|
| Molecular Weight | 450.14 g/mol |
| LogP | 0.4653 |
| Topological Polar Surface Area | 210.18 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.14368 |
| Heavy Atoms | 29 |
| Complexity | 666.53625 |
Chemical Identifiers
| CAS Number | 312693-79-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C[C@@H](C(=O)O)N)N.C1=CC(=CC=C1C[C@@H](C(=O)O)N)N.O.Cl.Cl |
Product Overview
(2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride (CAS 312693-79-1), with molecular formula C18H28Cl2N4O5 and molecular weight 450.14 g/mol. IUPAC: bis((2S)-2-amino-3-(4-aminophenyl)propanoic acid);hydrate;dihydrochloride.
Chemical Property Profile of (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride
Property Insights of (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride
The XLogP value of 0.4653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride. The TPSA of 210.18 Ų indicates high polarity, suggesting (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride?
The CAS number of (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride is 312693-79-1.
What is the molecular formula of (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride?
The molecular formula of (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride is C18H28Cl2N4O5.
What is the molecular weight of (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride?
The molecular weight of (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride is 450.14 g/mol.
Where can I buy (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride?
You can request a quote for (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-amino-3-(4-aminophenyl)propanoic acid;hydrate;dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.