ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate
TL;DR: ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate (CAS 340303-33-5) is a chemical compound with molecular formula C20H19NO2 and molecular weight 305.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-methyl-5-phenylpyrrol-1-yl)benzoate
Also Known As: ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate, ethyl 4-(2-methyl-5-phenylpyrrol-1-yl)benzoate, BAS 13120233, ethyl 4-(5-methyl-2-phenylpyrrolyl)benzoate, 4-(2-Methyl-5-phenyl-pyrrol-1-yl)-benzoic acid ethyl ester
| Molecular Formula | C20H19NO2 |
|---|---|
| Molecular Weight | 305.14 g/mol |
| LogP | 4.62942 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.14157 |
| Heavy Atoms | 23 |
| Complexity | 801.4179 |
Chemical Identifiers
| CAS Number | 340303-33-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=CC=C2C3=CC=CC=C3)C |
Product Overview
ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate (CAS 340303-33-5), with molecular formula C20H19NO2 and molecular weight 305.14 g/mol. IUPAC: ethyl 4-(2-methyl-5-phenylpyrrol-1-yl)benzoate.
Chemical Property Profile of ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate
Property Insights of ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate
The XLogP value of 4.62942 indicates that ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.23 Ų, ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate has 0 hydrogen bond donor(s) and 2 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 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate?
The CAS number of ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate is 340303-33-5.
What is the molecular formula of ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate?
The molecular formula of ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate is C20H19NO2.
What is the molecular weight of ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate?
The molecular weight of ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate is 305.14 g/mol.
Where can I buy ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate?
You can request a quote for ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(2-methyl-5-phenyl-1H-pyrrol-1-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.