methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate
TL;DR: methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate (CAS 338963-18-1) is a chemical compound with molecular formula C14H21NO2 and molecular weight 235.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-cyclohexyl-2-pyrrol-1-ylpropanoate
Also Known As: methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate, methyl 3-cyclohexyl-2-pyrrol-1-ylpropanoate, methyl 3-cyclohexyl-2-pyrrol-1-yl-propanoate, 5N-057, methyl 3-cyclohexyl-2-(pyrrol-1-yl)propanoate
| Molecular Formula | C14H21NO2 |
|---|---|
| Molecular Weight | 235.16 g/mol |
| LogP | 3.1726 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.15723 |
| Heavy Atoms | 17 |
| Complexity | 339.114 |
Chemical Identifiers
| CAS Number | 338963-18-1 |
|---|---|
| SMILES | COC(=O)C(CC1CCCCC1)N2C=CC=C2 |
Product Overview
methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate (CAS 338963-18-1), with molecular formula C14H21NO2 and molecular weight 235.16 g/mol. IUPAC: methyl 3-cyclohexyl-2-pyrrol-1-ylpropanoate.
Chemical Property Profile of methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate
Property Insights of methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate
The XLogP value of 3.1726 indicates that methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.23 Ų, methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate 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 methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate?
The CAS number of methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate is 338963-18-1.
What is the molecular formula of methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate?
The molecular formula of methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate is C14H21NO2.
What is the molecular weight of methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate?
The molecular weight of methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate is 235.16 g/mol.
Where can I buy methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate?
You can request a quote for methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-cyclohexyl-2-(1H-pyrrol-1-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.