4-Guanidino-methylphenylalanine
TL;DR: 4-Guanidino-methylphenylalanine (CAS 1991-97-5) is a chemical compound with molecular formula C11H16N4O2 and molecular weight 236.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-3-[4-[(diaminomethylideneamino)methyl]phenyl]propanoic acid
Also Known As: 4-Guanidino-methylphenylalanine, para-Guanidino-methylphenylalanine, p-Guanidinomethylphenylalanin, Alanine, 3-(alpha-guanidino-p-tolyl)-, Phenylalanine, 4-(((aminoiminomethyl)amino)methyl)-
| Molecular Formula | C11H16N4O2 |
|---|---|
| Molecular Weight | 236.13 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.12732 |
| Heavy Atoms | 17 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 1991-97-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C[C@@H](C(=O)O)N)CN=C(N)N |
| InChIKey | OSPFMSZZQUXLEB-VIFPVBQESA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Guanidino-methylphenylalanine (CAS 1991-97-5), with molecular formula C11H16N4O2 and molecular weight 236.13 g/mol. IUPAC: (2S)-2-amino-3-[4-[(diaminomethylideneamino)methyl]phenyl]propanoic acid.
Chemical Property Profile of 4-Guanidino-methylphenylalanine
Property Insights of 4-Guanidino-methylphenylalanine
The XLogP value of -3.1 indicates that 4-Guanidino-methylphenylalanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Guanidino-methylphenylalanine. Following Lipinski's Rule of Five, 4-Guanidino-methylphenylalanine has 4 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 4-Guanidino-methylphenylalanine?
The CAS number of 4-Guanidino-methylphenylalanine is 1991-97-5.
What is the molecular formula of 4-Guanidino-methylphenylalanine?
The molecular formula of 4-Guanidino-methylphenylalanine is C11H16N4O2.
What is the molecular weight of 4-Guanidino-methylphenylalanine?
The molecular weight of 4-Guanidino-methylphenylalanine is 236.13 g/mol.
Where can I buy 4-Guanidino-methylphenylalanine?
You can request a quote for 4-Guanidino-methylphenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Guanidino-methylphenylalanine?
Yes, KEHONG BIO provides custom synthesis services for 4-Guanidino-methylphenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.