ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate
TL;DR: ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate (CAS 860612-08-4) is a chemical compound with molecular formula C18H19NO2 and molecular weight 281.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylpyridine-3-carboxylate
Also Known As: Bionet2_001320, ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate, ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylpyridine-3-carboxylate, 6-indan-5-yl-2-methyl-nicotinic acid ethyl ester, ethyl 6-indan-5-yl-2-methyl-pyridine-3-carboxylate
| Molecular Formula | C18H19NO2 |
|---|---|
| Molecular Weight | 281.14 g/mol |
| LogP | 3.72242 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.14157 |
| Heavy Atoms | 21 |
| Complexity | 691.61285 |
Chemical Identifiers
| CAS Number | 860612-08-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(C=C1)C2=CC3=C(CCC3)C=C2)C |
Product Overview
ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate (CAS 860612-08-4), with molecular formula C18H19NO2 and molecular weight 281.14 g/mol. IUPAC: ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylpyridine-3-carboxylate.
Chemical Property Profile of ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate
Property Insights of ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate
The XLogP value of 3.72242 indicates that ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate has 0 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 ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate?
The CAS number of ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate is 860612-08-4.
What is the molecular formula of ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate?
The molecular formula of ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate is C18H19NO2.
What is the molecular weight of ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate?
The molecular weight of ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate is 281.14 g/mol.
Where can I buy ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate?
You can request a quote for ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 6-(2,3-dihydro-1H-inden-5-yl)-2-methylnicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.