dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate
TL;DR: dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate (CAS 849129-86-8) is a chemical compound with molecular formula C21H21NO6 and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate
Also Known As: dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate, Dimethyl 5-{2-[(2,3-dihydro-1H-inden-5-yl)amino]-2-oxoethoxy}benzene-1,3-dicarboxylate
| Molecular Formula | C21H21NO6 |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 2.766 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.1369 |
| Heavy Atoms | 28 |
| Complexity | 886.857 |
Chemical Identifiers
| CAS Number | 849129-86-8 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)OCC(=O)NC2=CC3=C(CCC3)C=C2)C(=O)OC |
Product Overview
dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate (CAS 849129-86-8), with molecular formula C21H21NO6 and molecular weight 383.14 g/mol. IUPAC: dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate.
Chemical Property Profile of dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate
Property Insights of dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate
The XLogP value of 2.766 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate. Following Lipinski's Rule of Five, dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate has 1 hydrogen bond donor(s) and 6 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 dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate?
The CAS number of dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate is 849129-86-8.
What is the molecular formula of dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate?
The molecular formula of dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate is C21H21NO6.
What is the molecular weight of dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate?
The molecular weight of dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate is 383.14 g/mol.
Where can I buy dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate?
You can request a quote for dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl 5-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzene-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.