![[2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate structure](/static/products/3323/332383-73-0.webp)
[2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate
TL;DR: [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate (CAS 332383-73-0) is a chemical compound with molecular formula C17H14N4O5 and molecular weight 354.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate
Also Known As: BAS 01538422, [2-(4-nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate, 2-(4-nitrophenyl)-2-oxoethyl 3-(1H-benzotriazol-1-yl)propanoate, 2-(4-nitrophenyl)-2-oxoethyl 3-benzotriazolylpropanoate, 3-Benzotriazol-1-yl-propionic acid 2-(4-nitro-phenyl)-2-oxo-ethyl ester
| Molecular Formula | C17H14N4O5 |
|---|---|
| Molecular Weight | 354.10 g/mol |
| LogP | 2.1557 |
| Topological Polar Surface Area | 117.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 354.0964 |
| Heavy Atoms | 26 |
| Complexity | 964.7035 |
Chemical Identifiers
| CAS Number | 332383-73-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2CCC(=O)OCC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
[2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate (CAS 332383-73-0), with molecular formula C17H14N4O5 and molecular weight 354.10 g/mol. IUPAC: [2-(4-nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate.
Chemical Property Profile of [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate
Property Insights of [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate
The XLogP value of 2.1557 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate. The TPSA of 117.22 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate. Following Lipinski's Rule of Five, [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate has 0 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 [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate?
The CAS number of [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate is 332383-73-0.
What is the molecular formula of [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate?
The molecular formula of [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate is C17H14N4O5.
What is the molecular weight of [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate?
The molecular weight of [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate is 354.10 g/mol.
Where can I buy [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate?
You can request a quote for [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Nitrophenyl)-2-oxoethyl] 3-(benzotriazol-1-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.