![(4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate structure](/static/products/5795/57950-57-9.webp)
(4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate
TL;DR: (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate (CAS 57950-57-9) is a chemical compound with molecular formula C16H18N4O7 and molecular weight 378.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate
Also Known As: (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate, 4-Nitrophenyl N-(2-methylprop-2-enoyl)glycylglycylglycinate, (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]
| Molecular Formula | C16H18N4O7 |
|---|---|
| Molecular Weight | 378.12 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 159.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 378.11755 |
| Heavy Atoms | 27 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 57950-57-9 |
|---|---|
| SMILES | CC(=C)C(=O)NCC(=O)NCC(=O)NCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | YWWIYCKDSDVEBC-UHFFFAOYSA-N |
Product Overview
(4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate (CAS 57950-57-9), with molecular formula C16H18N4O7 and molecular weight 378.12 g/mol. IUPAC: (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate.
Chemical Property Profile of (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate
Property Insights of (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate. The TPSA of 159.0 Ų indicates high polarity, suggesting (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate has 3 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 (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate?
The CAS number of (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate is 57950-57-9.
What is the molecular formula of (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate?
The molecular formula of (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate is C16H18N4O7.
What is the molecular weight of (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate?
The molecular weight of (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate is 378.12 g/mol.
Where can I buy (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate?
You can request a quote for (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for (4-nitrophenyl) 2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]acetyl]amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.