4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide
TL;DR: 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide (CAS 1016790-21-8) is a chemical compound with molecular formula C12H14N2O3S and molecular weight 266.0725 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-cyano-N-(oxolan-2-ylmethyl)benzenesulfonamide
Also Known As: 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide, 4-cyano-N-(oxolan-2-ylmethyl)benzenesulfonamide, 4-cyano-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide, AB00040974-01
Technical Specifications
| Molecular Formula | C12H14N2O3S |
| Molecular Weight | 266.0725 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 87.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.0725 Da |
| Heavy Atoms | 18 |
| Complexity | 412.0 |
| SMILES | C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)C#N |
| InChIKey | XNLAYXFXWXYRNR-UHFFFAOYSA-N |
Chemical Property Profile of 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide
Property Insights of 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide. The TPSA of 87.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide. Following Lipinski's Rule of Five, 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-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
What is the CAS number of 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide?
The CAS number of 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide is 1016790-21-8.
What is the molecular formula of 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide?
The molecular formula of 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide is C12H14N2O3S.
What is the molecular weight of 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide?
The molecular weight of 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide is 266.0725 g/mol.
Where can I buy 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide?
You can request a quote for 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide?
Yes, CoreyChem provides custom synthesis services for 4-cyano-N-(oxolan-2-ylmethyl)benzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.