N-(3-benzoyl-2-benzyl-1,1-dioxo-1
TL;DR: N-(3-benzoyl-2-benzyl-1,1-dioxo-1 (CAS 840514-91-2) is a chemical compound with molecular formula C28H23N3O6S and molecular weight 529.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-benzoyl-2-benzyl-1,1-dioxo-1λ6,2-benzothiazin-4-yl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide
Also Known As: N-(3-benzoyl-2-benzyl-1,1-dioxo-1, N-(3-BENZOYL-2-BENZYL-1,1-DIOXIDO-2H-1,2-BENZOTHIAZIN-4-YL)-2-(2,5-DIOXO-1-PYRROLIDINYL)ACETAMIDE, N-(3-benzoyl-2-benzyl-1,1-dioxido-2H-benzo[e][1,2]thiazin-4-yl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide, N-[2-benzyl-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl]-2-(2,5-dioxopyrrolidin-1-yl)acetamide
| Molecular Formula | C28H23N3O6S |
|---|---|
| Molecular Weight | 529.13 g/mol |
| LogP | 2.7078 |
| Topological Polar Surface Area | 120.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 529.13074 |
| Heavy Atoms | 38 |
| Complexity | 1567.0299 |
Chemical Identifiers
| CAS Number | 840514-91-2 |
|---|---|
| SMILES | C1CC(=O)N(C1=O)CC(=O)NC2=C(N(S(=O)(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5 |
Product Overview
N-(3-benzoyl-2-benzyl-1,1-dioxo-1 (CAS 840514-91-2), with molecular formula C28H23N3O6S and molecular weight 529.13 g/mol. IUPAC: N-(3-benzoyl-2-benzyl-1,1-dioxo-1λ6,2-benzothiazin-4-yl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide.
Chemical Property Profile of N-(3-benzoyl-2-benzyl-1,1-dioxo-1
Property Insights of N-(3-benzoyl-2-benzyl-1,1-dioxo-1
The XLogP value of 2.7078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-benzoyl-2-benzyl-1,1-dioxo-1. The TPSA of 120.93 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-benzoyl-2-benzyl-1,1-dioxo-1. Following Lipinski's Rule of Five, N-(3-benzoyl-2-benzyl-1,1-dioxo-1 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-benzoyl-2-benzyl-1,1-dioxo-1?
The CAS number of N-(3-benzoyl-2-benzyl-1,1-dioxo-1 is 840514-91-2.
What is the molecular formula of N-(3-benzoyl-2-benzyl-1,1-dioxo-1?
The molecular formula of N-(3-benzoyl-2-benzyl-1,1-dioxo-1 is C28H23N3O6S.
What is the molecular weight of N-(3-benzoyl-2-benzyl-1,1-dioxo-1?
The molecular weight of N-(3-benzoyl-2-benzyl-1,1-dioxo-1 is 529.13 g/mol.
Where can I buy N-(3-benzoyl-2-benzyl-1,1-dioxo-1?
You can request a quote for N-(3-benzoyl-2-benzyl-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 N-(3-benzoyl-2-benzyl-1,1-dioxo-1?
Yes, KEHONG BIO provides custom synthesis services for N-(3-benzoyl-2-benzyl-1,1-dioxo-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.