N(alpha)-tosyl-glycyl-3-amidinophenylalanine
TL;DR: N(alpha)-tosyl-glycyl-3-amidinophenylalanine (CAS 133397-82-7) is a chemical compound with molecular formula C19H22N4O5S and molecular weight 418.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-(3-carbamimidoylphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]propanoic acid
Also Known As: N-Tapa, N(alpha)-Tosyl-glycyl-3-amidinophenylalanine, N -tosyl-glycyl-3-amidinophenylalanine, (2S)-3-(3-carbamimidoylphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]propanoic acid, 3-(Aminoiminomethyl)-N-(N-((4-methylphenyl)sulfonyl)glycyl)-L-phenylalanine
| Molecular Formula | C19H22N4O5S |
|---|---|
| Molecular Weight | 418.13 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 171.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 418.1311 |
| Heavy Atoms | 29 |
| Complexity | 698.0 |
Chemical Identifiers
| CAS Number | 133397-82-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)N[C@@H](CC2=CC(=CC=C2)C(=N)N)C(=O)O |
| InChIKey | RSQLYPYEBNVFAQ-INIZCTEOSA-N |
Product Overview
N(alpha)-tosyl-glycyl-3-amidinophenylalanine (CAS 133397-82-7), with molecular formula C19H22N4O5S and molecular weight 418.13 g/mol. IUPAC: (2S)-3-(3-carbamimidoylphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]propanoic acid.
Chemical Property Profile of N(alpha)-tosyl-glycyl-3-amidinophenylalanine
Property Insights of N(alpha)-tosyl-glycyl-3-amidinophenylalanine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(alpha)-tosyl-glycyl-3-amidinophenylalanine. The TPSA of 171.0 Ų indicates high polarity, suggesting N(alpha)-tosyl-glycyl-3-amidinophenylalanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N(alpha)-tosyl-glycyl-3-amidinophenylalanine has 5 hydrogen bond donor(s) and 7 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 N(alpha)-tosyl-glycyl-3-amidinophenylalanine?
The CAS number of N(alpha)-tosyl-glycyl-3-amidinophenylalanine is 133397-82-7.
What is the molecular formula of N(alpha)-tosyl-glycyl-3-amidinophenylalanine?
The molecular formula of N(alpha)-tosyl-glycyl-3-amidinophenylalanine is C19H22N4O5S.
What is the molecular weight of N(alpha)-tosyl-glycyl-3-amidinophenylalanine?
The molecular weight of N(alpha)-tosyl-glycyl-3-amidinophenylalanine is 418.13 g/mol.
Where can I buy N(alpha)-tosyl-glycyl-3-amidinophenylalanine?
You can request a quote for N(alpha)-tosyl-glycyl-3-amidinophenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(alpha)-tosyl-glycyl-3-amidinophenylalanine?
Yes, KEHONG BIO provides custom synthesis services for N(alpha)-tosyl-glycyl-3-amidinophenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.