3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide
TL;DR: 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide (CAS 540518-65-8) is a chemical compound with molecular formula C16H16N2O5S and molecular weight 348.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide
Also Known As: CBKinase1_011550, CBKinase1_023950, 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide, AO-080/42479903, 3-oxo-N-(2-phenoxyethyl)-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
| Molecular Formula | C16H16N2O5S |
|---|---|
| Molecular Weight | 348.08 g/mol |
| LogP | 1.3748 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 348.078 |
| Heavy Atoms | 24 |
| Complexity | 836.8012 |
Chemical Identifiers
| CAS Number | 540518-65-8 |
|---|---|
| SMILES | C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NCCOC3=CC=CC=C3 |
Product Overview
3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide (CAS 540518-65-8), with molecular formula C16H16N2O5S and molecular weight 348.08 g/mol. IUPAC: 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide.
Chemical Property Profile of 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide
Property Insights of 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide
The XLogP value of 1.3748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide. The TPSA of 93.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide. Following Lipinski's Rule of Five, 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide has 2 hydrogen bond donor(s) and 5 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 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide?
The CAS number of 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide is 540518-65-8.
What is the molecular formula of 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide?
The molecular formula of 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide is C16H16N2O5S.
What is the molecular weight of 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide?
The molecular weight of 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide is 348.08 g/mol.
Where can I buy 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide?
You can request a quote for 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-oxo-N-(2-phenoxyethyl)-4H-1,4-benzoxazine-6-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.