4-[(3-benzoyl-2-ethyl-1,1-dioxo-1
TL;DR: 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1 (CAS 364595-17-5) is a chemical compound with molecular formula C28H26N4O4S and molecular weight 514.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-benzoyl-2-ethyl-1,1-dioxo-1λ6,2-benzothiazin-4-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1, AE-848/15341377, 4-[(3-benzoyl-2-ethyl-1,1-dioxido-2H-1,2-benzothiazin-4-yl)amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one, 4-[(3-Benzoyl-2-ethyl-1,1-dioxo-1lambda6,2-benzothiazin-4-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one, 4-{[2-ethyl-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C28H26N4O4S |
|---|---|
| Molecular Weight | 514.17 g/mol |
| LogP | 4.17222 |
| Topological Polar Surface Area | 93.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 514.1675 |
| Heavy Atoms | 37 |
| Complexity | 1702.0896 |
Chemical Identifiers
| CAS Number | 364595-17-5 |
|---|---|
| SMILES | CCN1C(=C(C2=CC=CC=C2S1(=O)=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C(=O)C5=CC=CC=C5 |
Product Overview
4-[(3-benzoyl-2-ethyl-1,1-dioxo-1 (CAS 364595-17-5), with molecular formula C28H26N4O4S and molecular weight 514.17 g/mol. IUPAC: 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1λ6,2-benzothiazin-4-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1
Property Insights of 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1
The XLogP value of 4.17222 indicates that 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1. Following Lipinski's Rule of Five, 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1?
The CAS number of 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1 is 364595-17-5.
What is the molecular formula of 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1?
The molecular formula of 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1 is C28H26N4O4S.
What is the molecular weight of 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1?
The molecular weight of 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1 is 514.17 g/mol.
Where can I buy 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1?
You can request a quote for 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3-benzoyl-2-ethyl-1,1-dioxo-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.