4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid
TL;DR: 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid (CAS 22230-37-1) is a chemical compound with molecular formula C11H13NO4S and molecular weight 255.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,1-dioxothiazinan-2-yl)benzoic acid
Also Known As: 4-(1,1-dioxido-1,2-thiazinan-2-yl)benzoic acid, 4-(1,1-dioxothiazinan-2-yl)benzoic acid, 4-(1,1-Dioxo-1lambda*6*-[1,2]thiazinan-2-yl)-benzoic acid, BAS 03220564, 4-(1,1-dioxo-2-thiazinanyl)benzoic acid
| Molecular Formula | C11H13NO4S |
|---|---|
| Molecular Weight | 255.06 g/mol |
| LogP | 1.3148 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.05653 |
| Heavy Atoms | 17 |
| Complexity | 520.90735 |
Chemical Identifiers
| CAS Number | 22230-37-1 |
|---|---|
| SMILES | C1CCS(=O)(=O)N(C1)C2=CC=C(C=C2)C(=O)O |
Product Overview
4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid (CAS 22230-37-1), with molecular formula C11H13NO4S and molecular weight 255.06 g/mol. IUPAC: 4-(1,1-dioxothiazinan-2-yl)benzoic acid.
Chemical Property Profile of 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid
Property Insights of 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid
The XLogP value of 1.3148 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid. Following Lipinski's Rule of Five, 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid has 1 hydrogen bond donor(s) and 3 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 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid?
The CAS number of 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid is 22230-37-1.
What is the molecular formula of 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid?
The molecular formula of 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid is C11H13NO4S.
What is the molecular weight of 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid?
The molecular weight of 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid is 255.06 g/mol.
Where can I buy 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid?
You can request a quote for 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,1-Dioxo-1-Lambda-6,2-Thiazinan-2-Yl)Benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.