N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide
TL;DR: N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide (CAS 216757-29-8) is a chemical compound with molecular formula C28H38N6O11 and molecular weight 634.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S)-4-[[(2S,3S)-2-acetamido-3-methylpentanoyl]amino]-5-[(2S)-2-[[(2S)-3-carboxy-1-(4-nitroanilino)-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-5-oxopentanoic acid
Also Known As: N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide, 1-Bromo-3-bromomethyl-5-fluoro-benzene, Acetyl-Ile-Glu-Thr-Asp-paranitroanilide, N-ACETYL-ILE-GLU-PRO-ASP-P-NITROANILINE, (4S)-4-[[(2S,3S)-2-acetamido-3-methylpentanoyl]amino]-5-[(2S)-2-[[(2S)-3-carboxy-1-(4-nitroanilino)-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-5-oxopentanoic acid
| Molecular Formula | C28H38N6O11 |
|---|---|
| Molecular Weight | 634.26 g/mol |
| LogP | 0.3842 |
| Topological Polar Surface Area | 254.45 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 16 |
| Exact Mass | 634.2598 |
| Heavy Atoms | 45 |
| Complexity | 1302.1715 |
Chemical Identifiers
| CAS Number | 216757-29-8 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C |
Product Overview
N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide (CAS 216757-29-8), with molecular formula C28H38N6O11 and molecular weight 634.26 g/mol. IUPAC: (4S)-4-[[(2S,3S)-2-acetamido-3-methylpentanoyl]amino]-5-[(2S)-2-[[(2S)-3-carboxy-1-(4-nitroanilino)-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-5-oxopentanoic acid.
Chemical Property Profile of N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide
Property Insights of N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide
The XLogP value of 0.3842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide. The TPSA of 254.45 Ų indicates high polarity, suggesting N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide?
The CAS number of N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide is 216757-29-8.
What is the molecular formula of N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide?
The molecular formula of N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide is C28H38N6O11.
What is the molecular weight of N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide?
The molecular weight of N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide is 634.26 g/mol.
Where can I buy N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide?
You can request a quote for N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide?
Yes, KEHONG BIO provides custom synthesis services for N-Acetyl-Ile-Glu-Pro-Asp-p-nitroanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.