AB00115672-01
TL;DR: AB00115672-01 (CAS 370852-45-2) is a chemical compound with molecular formula C20H18BrNO5 and molecular weight 431.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-[2-(4-bromophenyl)-2-oxoethyl]-3-hydroxy-2-oxoindol-1-yl]acetate
Also Known As: AB00115672-01, ethyl {3-[2-(4-bromophenyl)-2-oxoethyl]-3-hydroxy-2-oxo-2,3-dihydro-1H-indol-1-yl}acetate, ethyl 2-(3-(2-(4-bromophenyl)-2-oxoethyl)-3-hydroxy-2-oxoindolin-1-yl)acetate, Ethyl 2-[3-[2-(4-bromophenyl)-2-oxo-ethyl]-3-hydroxy-2-oxo-indol-1-yl]acetate, ethyl 2-[3-[2-(4-bromophenyl)-2-oxoethyl]-3-hydroxy-2-oxoindol-1-yl]acetate
| Molecular Formula | C20H18BrNO5 |
|---|---|
| Molecular Weight | 431.04 g/mol |
| LogP | 2.8194 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.03683 |
| Heavy Atoms | 27 |
| Complexity | 895.5 |
Chemical Identifiers
| CAS Number | 370852-45-2 |
|---|---|
| SMILES | CCOC(=O)CN1C2=CC=CC=C2C(C1=O)(CC(=O)C3=CC=C(C=C3)Br)O |
Product Overview
AB00115672-01 (CAS 370852-45-2), with molecular formula C20H18BrNO5 and molecular weight 431.04 g/mol. IUPAC: ethyl 2-[3-[2-(4-bromophenyl)-2-oxoethyl]-3-hydroxy-2-oxoindol-1-yl]acetate.
Chemical Property Profile of AB00115672-01
Property Insights of AB00115672-01
The XLogP value of 2.8194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00115672-01. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00115672-01. Following Lipinski's Rule of Five, AB00115672-01 has 1 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 AB00115672-01?
The CAS number of AB00115672-01 is 370852-45-2.
What is the molecular formula of AB00115672-01?
The molecular formula of AB00115672-01 is C20H18BrNO5.
What is the molecular weight of AB00115672-01?
The molecular weight of AB00115672-01 is 431.04 g/mol.
Where can I buy AB00115672-01?
You can request a quote for AB00115672-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00115672-01?
Yes, KEHONG BIO provides custom synthesis services for AB00115672-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.