![ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate structure](/static/products/221/22137-55-9.png)
ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate
TL;DR: ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate (CAS 22137-55-9) is a chemical compound with molecular formula C21H19N3O5 and molecular weight 393.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate
Also Known As: ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate
| Molecular Formula | C21H19N3O5 |
|---|---|
| Molecular Weight | 393.13 g/mol |
| LogP | 4.34572 |
| Topological Polar Surface Area | 106.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.13248 |
| Heavy Atoms | 29 |
| Complexity | 1069.946 |
Chemical Identifiers
| CAS Number | 22137-55-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])/C=N\O)C3=CC=CC=C3)C |
Product Overview
ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate (CAS 22137-55-9), with molecular formula C21H19N3O5 and molecular weight 393.13 g/mol. IUPAC: ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate.
Chemical Property Profile of ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate
Property Insights of ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate
The XLogP value of 4.34572 indicates that ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.96 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate. Following Lipinski's Rule of Five, ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate has 1 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 ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate?
The CAS number of ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate is 22137-55-9.
What is the molecular formula of ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate?
The molecular formula of ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate is C21H19N3O5.
What is the molecular weight of ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate?
The molecular weight of ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate is 393.13 g/mol.
Where can I buy ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate?
You can request a quote for ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-[(Z)-hydroxyiminomethyl]-2-methyl-4-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.