tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide
TL;DR: tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide (CAS 16111-57-2) is a chemical compound with molecular formula C24H34N4O6 and molecular weight 474.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2S)-1-[[(3S)-1-(1-amino-1-oxo-3-phenylpropan-2-yl)-2,5-dioxopyrrolidin-3-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate
Also Known As: Boc-leu-asu-phe-NH2, tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide, tert-butyl N-[(2S)-1-[[(3S)-1-(1-amino-1-oxo-3-phenylpropan-2-yl)-2,5-dioxopyrrolidin-3-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate, (2S)-2-{[tert-Butoxy(hydroxy)methylidene]amino}-N-[(3S)-1-(1-hydroxy-1-imino-3-phenylpropan-2-yl)-2,5-dioxopyrrolidin-3-yl]-4-methylpentanimidic acid, 2-{[tert-Butoxy(hydroxy)methylidene]amino}-N-[1-(1-hydroxy-1-imino-3-phenylpropan-2-yl)-2,5-dioxopyrrolidin-3-yl]-4-methylpentanimidic acid
| Molecular Formula | C24H34N4O6 |
|---|---|
| Molecular Weight | 474.25 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 474.24783 |
| Heavy Atoms | 34 |
| Complexity | 785.0 |
Chemical Identifiers
| CAS Number | 16111-57-2 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)N[C@H]1CC(=O)N(C1=O)C(CC2=CC=CC=C2)C(=O)N)NC(=O)OC(C)(C)C |
| InChIKey | RCOSIAQBXIYIDW-UBFHEZILSA-N |
Product Overview
tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide (CAS 16111-57-2), with molecular formula C24H34N4O6 and molecular weight 474.25 g/mol. IUPAC: tert-butyl N-[(2S)-1-[[(3S)-1-(1-amino-1-oxo-3-phenylpropan-2-yl)-2,5-dioxopyrrolidin-3-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate.
Chemical Property Profile of tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide
Property Insights of tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide. The TPSA of 148.0 Ų indicates high polarity, suggesting tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide has 3 hydrogen bond donor(s) and 6 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 tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide?
The CAS number of tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide is 16111-57-2.
What is the molecular formula of tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide?
The molecular formula of tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide is C24H34N4O6.
What is the molecular weight of tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide?
The molecular weight of tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide is 474.25 g/mol.
Where can I buy tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide?
You can request a quote for tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyloxycarbonylleucyl-aminosuccinyl-phenylalaninamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.