N-(3-benzoyl-1,1-dioxo-2-pentyl-1
TL;DR: N-(3-benzoyl-1,1-dioxo-2-pentyl-1 (CAS 577963-38-3) is a chemical compound with molecular formula C29H30N2O6S and molecular weight 534.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-benzoyl-1,1-dioxo-2-pentyl-1λ6,2-benzothiazin-4-yl)-2-(4-methoxyphenoxy)acetamide
Also Known As: N-(3-benzoyl-1,1-dioxo-2-pentyl-1, N-(3-benzoyl-1,1-dioxido-2-pentyl-2H-1,2-benzothiazin-4-yl)-2-(4-methoxyphenoxy)acetamide, N-(3-benzoyl-1,1-dioxido-2-pentyl-2H-benzo[e][1,2]thiazin-4-yl)-2-(4-methoxyphenoxy)acetamide, N-[1,1-dioxido-2-pentyl-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl]-2-(4-methoxyphenoxy)acetamide
| Molecular Formula | C29H30N2O6S |
|---|---|
| Molecular Weight | 534.18 g/mol |
| LogP | 4.6364 |
| Topological Polar Surface Area | 102.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 534.18243 |
| Heavy Atoms | 38 |
| Complexity | 1433.4048 |
Chemical Identifiers
| CAS Number | 577963-38-3 |
|---|---|
| SMILES | CCCCCN1C(=C(C2=CC=CC=C2S1(=O)=O)NC(=O)COC3=CC=C(C=C3)OC)C(=O)C4=CC=CC=C4 |
Product Overview
N-(3-benzoyl-1,1-dioxo-2-pentyl-1 (CAS 577963-38-3), with molecular formula C29H30N2O6S and molecular weight 534.18 g/mol. IUPAC: N-(3-benzoyl-1,1-dioxo-2-pentyl-1λ6,2-benzothiazin-4-yl)-2-(4-methoxyphenoxy)acetamide.
Chemical Property Profile of N-(3-benzoyl-1,1-dioxo-2-pentyl-1
Property Insights of N-(3-benzoyl-1,1-dioxo-2-pentyl-1
The XLogP value of 4.6364 indicates that N-(3-benzoyl-1,1-dioxo-2-pentyl-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.01 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-benzoyl-1,1-dioxo-2-pentyl-1. Following Lipinski's Rule of Five, N-(3-benzoyl-1,1-dioxo-2-pentyl-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-1,1-dioxo-2-pentyl-1?
The CAS number of N-(3-benzoyl-1,1-dioxo-2-pentyl-1 is 577963-38-3.
What is the molecular formula of N-(3-benzoyl-1,1-dioxo-2-pentyl-1?
The molecular formula of N-(3-benzoyl-1,1-dioxo-2-pentyl-1 is C29H30N2O6S.
What is the molecular weight of N-(3-benzoyl-1,1-dioxo-2-pentyl-1?
The molecular weight of N-(3-benzoyl-1,1-dioxo-2-pentyl-1 is 534.18 g/mol.
Where can I buy N-(3-benzoyl-1,1-dioxo-2-pentyl-1?
You can request a quote for N-(3-benzoyl-1,1-dioxo-2-pentyl-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-1,1-dioxo-2-pentyl-1?
Yes, KEHONG BIO provides custom synthesis services for N-(3-benzoyl-1,1-dioxo-2-pentyl-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.