(E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate
TL;DR: (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate (CAS 370075-83-5) is a chemical compound with molecular formula C20H17ClN2O2 and molecular weight 352.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(3-chlorophenyl)iminomethyl]-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate
Also Known As: (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate, methyl (5E)-5-[(3-chloroanilino)methylidene]-2-methyl-4-phenylpyrrole-3-carboxylate, methyl (5Z)-5-[(3-chloroanilino)methylidene]-2-methyl-4-phenylpyrrole-3-carboxylate, methyl 5-[(3-chloroanilino)methylidene]-2-methyl-4-phenylpyrrole-3-carboxylate, methyl 5-{(E)-[(3-chlorophenyl)imino]methyl}-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate
| Molecular Formula | C20H17ClN2O2 |
|---|---|
| Molecular Weight | 352.10 g/mol |
| LogP | 5.18072 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.09787 |
| Heavy Atoms | 25 |
| Complexity | 930.12415 |
Chemical Identifiers
| CAS Number | 370075-83-5 |
|---|---|
| SMILES | CC1=C(C(=C(N1)C=NC2=CC(=CC=C2)Cl)C3=CC=CC=C3)C(=O)OC |
Product Overview
(E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate (CAS 370075-83-5), with molecular formula C20H17ClN2O2 and molecular weight 352.10 g/mol. IUPAC: methyl 5-[(3-chlorophenyl)iminomethyl]-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate.
Chemical Property Profile of (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate
Property Insights of (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate
The XLogP value of 5.18072 indicates that (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.45 Ų, (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate?
The CAS number of (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate is 370075-83-5.
What is the molecular formula of (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate?
The molecular formula of (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate is C20H17ClN2O2.
What is the molecular weight of (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate?
The molecular weight of (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate is 352.10 g/mol.
Where can I buy (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate?
You can request a quote for (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 5-(((3-chlorophenyl)imino)methyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.