N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine
TL;DR: N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine (CAS 121613-01-2) is a chemical compound with molecular formula C25H31N3O7 and molecular weight 485.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(2S)-1-(carboxymethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid
Also Known As: Z-CA-Gly-phe, N-(1-Carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine, 2-[[(2S)-1-(carboxymethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid, n-(5-{[(benzyloxy)carbonyl]amino}-1-carboxypentyl)-l-phenylalanylglycine, N~6~-[(Benzyloxy)(hydroxy)methylidene]-N~2~-{(2S)-1-[(carboxymethyl)imino]-1-hydroxy-3-phenylpropan-2-yl}lysine
| Molecular Formula | C25H31N3O7 |
|---|---|
| Molecular Weight | 485.22 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 154.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Exact Mass | 485.2162 |
| Heavy Atoms | 35 |
| Complexity | 676.0 |
Chemical Identifiers
| CAS Number | 121613-01-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[C@@H](C(=O)NCC(=O)O)NC(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)O |
| InChIKey | PUMZVPXPQCBTAM-LBAQZLPGSA-N |
Product Overview
N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine (CAS 121613-01-2), with molecular formula C25H31N3O7 and molecular weight 485.22 g/mol. IUPAC: 2-[[(2S)-1-(carboxymethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-6-(phenylmethoxycarbonylamino)hexanoic acid.
Chemical Property Profile of N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine
Property Insights of N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine. The TPSA of 154.0 Ų indicates high polarity, suggesting N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine has 5 hydrogen bond donor(s) and 8 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-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine?
The CAS number of N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine is 121613-01-2.
What is the molecular formula of N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine?
The molecular formula of N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine is C25H31N3O7.
What is the molecular weight of N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine?
The molecular weight of N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine is 485.22 g/mol.
Where can I buy N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine?
You can request a quote for N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for N-(1-carboxy-5-carbobenzoxyaminopentyl)-glycyl-phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.