[2-[(3-benzoyl-1,1-dioxo-2-pentyl-1
TL;DR: [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1 (CAS 840485-13-4) is a chemical compound with molecular formula C29H28N2O6S and molecular weight 532.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(3-benzoyl-1,1-dioxo-2-pentyl-1λ6,2-benzothiazin-4-yl)carbamoyl]phenyl] acetate
Also Known As: [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1|2-((3-benzoyl-1,1-dioxido-2-pentyl-2H-benzo[e][1,2]thiazin-4-yl)carbamoyl)phenyl acetate|2-[(3-BENZOYL-1,1-DIOXIDO-2-PENTYL-2H-1,2-BENZOTHIAZIN-4-YL)CARBAMOYL]PHENYL ACETATE|2-{[1,1-dioxido-2-pentyl-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl]carbamoyl}phenyl acetate
| Molecular Formula | C29H28N2O6S |
|---|---|
| Molecular Weight | 532.17 g/mol |
| LogP | 4.7879 |
| Topological Polar Surface Area | 109.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 532.1668 |
| Heavy Atoms | 38 |
| Complexity | 1512.7827 |
Chemical Identifiers
| CAS Number | 840485-13-4 |
|---|---|
| SMILES | CCCCCN1C(=C(C2=CC=CC=C2S1(=O)=O)NC(=O)C3=CC=CC=C3OC(=O)C)C(=O)C4=CC=CC=C4 |
Product Overview
[2-[(3-benzoyl-1,1-dioxo-2-pentyl-1 (CAS 840485-13-4), with molecular formula C29H28N2O6S and molecular weight 532.17 g/mol. IUPAC: [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1λ6,2-benzothiazin-4-yl)carbamoyl]phenyl] acetate.
Chemical Property Profile of [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1
Property Insights of [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1
The XLogP value of 4.7879 indicates that [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.85 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1. Following Lipinski's Rule of Five, [2-[(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 [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1?
The CAS number of [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1 is 840485-13-4.
What is the molecular formula of [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1?
The molecular formula of [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1 is C29H28N2O6S.
What is the molecular weight of [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1?
The molecular weight of [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1 is 532.17 g/mol.
Where can I buy [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1?
You can request a quote for [2-[(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 [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1?
Yes, KEHONG BIO provides custom synthesis services for [2-[(3-benzoyl-1,1-dioxo-2-pentyl-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.