2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide
TL;DR: 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide (CAS 1222-40-8) is a chemical compound with molecular formula C12H17NO4S2 and molecular weight 303.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-6-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-7-sulfonamide
Also Known As: 2H-1-Benzothiopyran-7-sulfonamide, 2-ethyl-3,4-dihydro-6-methyl-,1,1-dioxide, 2-ethyl-6-methyl-3,4-dihydro-2h-thiochromene-7-sulfonamide 1,1-dioxide, 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide, 2-ethyl-6-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-7-sulfonamide, 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~-benzothiopyran-7-sulfonamide
| Molecular Formula | C12H17NO4S2 |
|---|---|
| Molecular Weight | 303.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.0599 |
| Heavy Atoms | 19 |
| Complexity | 529.0 |
Chemical Identifiers
| CAS Number | 1222-40-8 |
|---|---|
| SMILES | CCC1CCC2=C(S1(=O)=O)C=C(C(=C2)C)S(=O)(=O)N |
| InChIKey | UWACTLZRFVZIPC-UHFFFAOYSA-N |
Product Overview
2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide (CAS 1222-40-8), with molecular formula C12H17NO4S2 and molecular weight 303.06 g/mol. IUPAC: 2-ethyl-6-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-7-sulfonamide.
Chemical Property Profile of 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide
Property Insights of 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide. Following Lipinski's Rule of Five, 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide has 1 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 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide?
The CAS number of 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide is 1222-40-8.
What is the molecular formula of 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide?
The molecular formula of 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide is C12H17NO4S2.
What is the molecular weight of 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide?
The molecular weight of 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide is 303.06 g/mol.
Where can I buy 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide?
You can request a quote for 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-6-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1-benzothiopyran-7-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.