ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate
TL;DR: ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate (CAS 784-60-1) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate
Also Known As: NCIOpen2_003258, ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate, Ethyl N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)glycinate, ethyl 2-((2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino)acetate
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 784-60-1 |
|---|---|
| SMILES | CCOC(=O)CNC1C(CC2=CC=CC=C12)O |
| InChIKey | WKPQEPBDFRMDOG-UHFFFAOYSA-N |
Product Overview
ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate (CAS 784-60-1), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate.
Chemical Property Profile of ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate
Property Insights of ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate. With a topological polar surface area (TPSA) of 58.6 Ų, ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate has 2 hydrogen bond donor(s) and 4 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 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate?
The CAS number of ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate is 784-60-1.
What is the molecular formula of ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate?
The molecular formula of ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate is C13H17NO3.
What is the molecular weight of ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate?
The molecular weight of ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate is 235.12 g/mol.
Where can I buy ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate?
You can request a quote for ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.