A2974/0125357
TL;DR: A2974/0125357 (CAS 956796-41-1) is a chemical compound with molecular formula C19H17BrN4O5 and molecular weight 460.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-[2-(5-bromopyridine-3-carbonyl)hydrazinyl]-2,5-dioxopyrrolidin-1-yl]benzoate
Also Known As: A2974/0125357, ethyl 4-(3-{2-[(5-bromopyridin-3-yl)carbonyl]hydrazinyl}-2,5-dioxopyrrolidin-1-yl)benzoate, ethyl 4-(3-(2-(5-bromonicotinoyl)hydrazinyl)-2,5-dioxopyrrolidin-1-yl)benzoate, ETHYL 4-[3-(5-BROMOPYRIDIN-3-YLHYDRAZIDO)-2,5-DIOXOPYRROLIDIN-1-YL]BENZOATE, ethyl 4-[3-[2-(5-bromopyridine-3-carbonyl)hydrazinyl]-2,5-dioxopyrrolidin-1-yl]benzoate
| Molecular Formula | C19H17BrN4O5 |
|---|---|
| Molecular Weight | 460.04 g/mol |
| LogP | 1.5873 |
| Topological Polar Surface Area | 117.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.03824 |
| Heavy Atoms | 29 |
| Complexity | 963.3268 |
Chemical Identifiers
| CAS Number | 956796-41-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)NNC(=O)C3=CC(=CN=C3)Br |
Product Overview
A2974/0125357 (CAS 956796-41-1), with molecular formula C19H17BrN4O5 and molecular weight 460.04 g/mol. IUPAC: ethyl 4-[3-[2-(5-bromopyridine-3-carbonyl)hydrazinyl]-2,5-dioxopyrrolidin-1-yl]benzoate.
Chemical Property Profile of A2974/0125357
Property Insights of A2974/0125357
The XLogP value of 1.5873 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2974/0125357. The TPSA of 117.7 Ų falls within the moderate polarity range, balancing permeability and solubility for A2974/0125357. Following Lipinski's Rule of Five, A2974/0125357 has 2 hydrogen bond donor(s) and 7 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 A2974/0125357?
The CAS number of A2974/0125357 is 956796-41-1.
What is the molecular formula of A2974/0125357?
The molecular formula of A2974/0125357 is C19H17BrN4O5.
What is the molecular weight of A2974/0125357?
The molecular weight of A2974/0125357 is 460.04 g/mol.
Where can I buy A2974/0125357?
You can request a quote for A2974/0125357 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2974/0125357?
Yes, KEHONG BIO provides custom synthesis services for A2974/0125357 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.