dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate)
TL;DR: dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate) (CAS 371227-46-2) is a chemical compound with molecular formula C31H32N4O4 and molecular weight 524.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[[4-[[4-[(4-methoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)methylideneamino]phenyl]methyl]phenyl]iminomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Also Known As: dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate), dimethyl 5,5'-{methanediylbis[benzene-4,1-diylnitrilo(E)methylylidene]}bis(2,4-dimethyl-1H-pyrrole-3-carboxylate), methyl 5-[[4-[[4-[(4-methoxycarbonyl-3,5-dimethylpyrrol-2-ylidene)methylamino]phenyl]methyl]anilino]methylidene]-2,4-dimethylpyrrole-3-carboxylate
| Molecular Formula | C31H32N4O4 |
|---|---|
| Molecular Weight | 524.24 g/mol |
| LogP | 6.24168 |
| Topological Polar Surface Area | 108.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 524.2424 |
| Heavy Atoms | 39 |
| Complexity | 1437.8033 |
Chemical Identifiers
| CAS Number | 371227-46-2 |
|---|---|
| SMILES | CC1=C(NC(=C1C(=O)OC)C)C=NC2=CC=C(C=C2)CC3=CC=C(C=C3)N=CC4=C(C(=C(N4)C)C(=O)OC)C |
Product Overview
dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate) (CAS 371227-46-2), with molecular formula C31H32N4O4 and molecular weight 524.24 g/mol. IUPAC: methyl 5-[[4-[[4-[(4-methoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)methylideneamino]phenyl]methyl]phenyl]iminomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate.
Chemical Property Profile of dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate)
Property Insights of dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate)
The XLogP value of 6.24168 indicates that dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.9 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate). Following Lipinski's Rule of Five, dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate) has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate)?
The CAS number of dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate) is 371227-46-2.
What is the molecular formula of dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate)?
The molecular formula of dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate) is C31H32N4O4.
What is the molecular weight of dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate)?
The molecular weight of dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate) is 524.24 g/mol.
Where can I buy dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate)?
You can request a quote for dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-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 dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate)?
Yes, KEHONG BIO provides custom synthesis services for dimethyl 5,5'-((1E,1'E)-((methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(2,4-dimethyl-1H-pyrrole-3-carboxylate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.