Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester
TL;DR: Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester (CAS 98236-93-2) is a chemical compound with molecular formula C12H11N3O4 and molecular weight 261.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-hydroxy-1H-indol-3-yl)diazenyl]-2-oxoacetate
Also Known As: BAS 00391999, NCI60_036558, ethyl 2-oxo-2-[2-(2-oxoindol-3-yl)hydrazinyl]acetate, (E)-ethyl 2-oxo-2-(2-(2-oxoindolin-3-ylidene)hydrazinyl)acetate, ethyl 2-oxo-2-[(2E)-2-(2-oxoindolin-3-ylidene)hydrazino]acetate
| Molecular Formula | C12H11N3O4 |
|---|---|
| Molecular Weight | 261.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.07495 |
| Heavy Atoms | 19 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 98236-93-2 |
|---|---|
| SMILES | CCOC(=O)C(=O)N=NC1=C(NC2=CC=CC=C21)O |
| InChIKey | YGEPQINLIMIKPR-UHFFFAOYSA-N |
Product Overview
Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester (CAS 98236-93-2), with molecular formula C12H11N3O4 and molecular weight 261.07 g/mol. IUPAC: ethyl 2-[(2-hydroxy-1H-indol-3-yl)diazenyl]-2-oxoacetate.
Chemical Property Profile of Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester
Property Insights of Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester. Following Lipinski's Rule of Five, Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester has 2 hydrogen bond donor(s) and 5 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 Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester?
The CAS number of Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester is 98236-93-2.
What is the molecular formula of Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester?
The molecular formula of Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester is C12H11N3O4.
What is the molecular weight of Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester?
The molecular weight of Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester is 261.07 g/mol.
Where can I buy Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester?
You can request a quote for Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Oxo-[N'-(2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazino]-acetic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.