methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate
TL;DR: methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate (CAS 477871-45-7) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(2,5-dimethylpyrrol-1-yl)-2-hydroxybenzoate
Also Known As: methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate, methyl 4-(2,5-dimethylpyrrol-1-yl)-2-hydroxybenzoate, 1R-0642, methyl 4-(2,5-dimethylpyrrol-1-yl)-2-hydroxy-benzoate, methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoate
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 2.58634 |
| Topological Polar Surface Area | 51.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 579.5817 |
Chemical Identifiers
| CAS Number | 477871-45-7 |
|---|---|
| SMILES | CC1=CC=C(N1C2=CC(=C(C=C2)C(=O)OC)O)C |
Product Overview
methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate (CAS 477871-45-7), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: methyl 4-(2,5-dimethylpyrrol-1-yl)-2-hydroxybenzoate.
Chemical Property Profile of methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate
Property Insights of methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate
The XLogP value of 2.58634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate. With a topological polar surface area (TPSA) of 51.46 Ų, methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate has 1 hydrogen bond donor(s) and 3 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 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate?
The CAS number of methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate is 477871-45-7.
What is the molecular formula of methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate?
The molecular formula of methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate is C14H15NO3.
What is the molecular weight of methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate?
The molecular weight of methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate is 245.11 g/mol.
Where can I buy methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate?
You can request a quote for methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.