3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen
TL;DR: 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen (CAS 27799-56-0) is a chemical compound with molecular formula C19H24N2O4 and molecular weight 344.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[(3-ethoxycarbonyl-4,5-dimethyl-1H-pyrrol-2-yl)methylidene]-4,5-dimethylpyrrole-3-carboxylate
Also Known As: 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen, ethyl (2Z)-2-[(3-ethoxycarbonyl-4,5-dimethyl-1H-pyrrol-2-yl)methylidene]-4,5-dimethylpyrrole-3-carboxylate, ethyl 2-{[3-(ethoxycarbonyl)-4,5-dimethyl-2h-pyrrol-2-ylidene]methyl}-4,5-dimethyl-1h-pyrrole-3-carboxylate, ethyl 2-[(3-ethoxycarbonyl-4,5-dimethyl-1H-pyrrol-2-yl)methylidene]-4,5-dimethylpyrrole-3-carboxylate
| Molecular Formula | C19H24N2O4 |
|---|---|
| Molecular Weight | 344.17 g/mol |
| LogP | 3.50324 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.1736 |
| Heavy Atoms | 25 |
| Complexity | 809.63556 |
Chemical Identifiers
| CAS Number | 27799-56-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C1C)C)/C=C\2/C(=C(C(=N2)C)C)C(=O)OCC |
Product Overview
3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen (CAS 27799-56-0), with molecular formula C19H24N2O4 and molecular weight 344.17 g/mol. IUPAC: ethyl (2Z)-2-[(3-ethoxycarbonyl-4,5-dimethyl-1H-pyrrol-2-yl)methylidene]-4,5-dimethylpyrrole-3-carboxylate.
Chemical Property Profile of 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen
Property Insights of 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen
The XLogP value of 3.50324 indicates that 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen. Following Lipinski's Rule of Five, 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen has 1 hydrogen bond donor(s) and 5 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 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen?
The CAS number of 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen is 27799-56-0.
What is the molecular formula of 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen?
The molecular formula of 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen is C19H24N2O4.
What is the molecular weight of 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen?
The molecular weight of 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen is 344.17 g/mol.
Where can I buy 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen?
You can request a quote for 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Diethoxycarbonyl-4,5,4',5'-tetramethyl-dipyrromethen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.