N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine
TL;DR: N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine (CAS 121635-44-7) is a chemical compound with molecular formula C20H30N2O6 and molecular weight 394.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(1S)-1-carboxy-2-phenylethyl]amino]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid
Also Known As: Boc-CA-phe, N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine, 2-[[(1S)-1-carboxy-2-phenylethyl]amino]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid, N-(5-{[tert-Butoxy(hydroxy)methylidene]amino}-1-carboxypentyl)phenylalanine, N-(5-{[tert-Butoxy(hydroxy)methylidene]amino}-1-carboxypentyl)-L-phenylalanine
| Molecular Formula | C20H30N2O6 |
|---|---|
| Molecular Weight | 394.21 g/mol |
| LogP | 2.4201 |
| Topological Polar Surface Area | 124.96 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 394.2104 |
| Heavy Atoms | 28 |
| Complexity | 641.846 |
Chemical Identifiers
| CAS Number | 121635-44-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCCCCC(C(=O)O)N[C@@H](CC1=CC=CC=C1)C(=O)O |
Product Overview
N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine (CAS 121635-44-7), with molecular formula C20H30N2O6 and molecular weight 394.21 g/mol. IUPAC: 2-[[(1S)-1-carboxy-2-phenylethyl]amino]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid.
Chemical Property Profile of N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine
Property Insights of N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine
The XLogP value of 2.4201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine. The TPSA of 124.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine. Following Lipinski's Rule of Five, N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine has 4 hydrogen bond donor(s) and 5 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-tert-butoxycarbonylaminopentyl)-phenylalanine?
The CAS number of N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine is 121635-44-7.
What is the molecular formula of N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine?
The molecular formula of N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine is C20H30N2O6.
What is the molecular weight of N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine?
The molecular weight of N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine is 394.21 g/mol.
Where can I buy N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine?
You can request a quote for N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-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-tert-butoxycarbonylaminopentyl)-phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for N-(1-Carboxy-5-tert-butoxycarbonylaminopentyl)-phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.