4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide
TL;DR: 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide (CAS 127810-37-1) is a chemical compound with molecular formula C12H10N2O2S and molecular weight 246.0463 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide
Also Known As: 3H-1,2,3,5-Oxathiadiazole, 4-(2-naphthalenylmethyl)-, 2-oxide, 4-(2-Naphthylmethyl)-3H-1,2,3,5-oxathiadiazole 2-oxide, 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide, 4-[(2-Naphthyl)methyl]-3H-1,2,3,5-oxathiadiazole 2-oxide, 4-[(naphthalen-2-yl)methyl]-2,3-dihydro-1,2,3,5-oxathiadiazol-2-ium-2-olate
Technical Specifications
| Molecular Formula | C12H10N2O2S |
| Molecular Weight | 246.0463 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 87.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.0463 Da |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
| SMILES | C1=CC=C2C=C(C=CC2=C1)CC3=NS(=O)ON3 |
| InChIKey | JDZJQMZKLLQXMR-UHFFFAOYSA-N |
Chemical Property Profile of 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide
Property Insights of 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide. The TPSA of 87.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide. Following Lipinski's Rule of Five, 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide has 1 hydrogen bond donor(s) and 4 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-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide?
The CAS number of 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide is 127810-37-1.
What is the molecular formula of 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide?
The molecular formula of 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide is C12H10N2O2S.
What is the molecular weight of 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide?
The molecular weight of 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide is 246.0463 g/mol.
Where can I buy 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide?
You can request a quote for 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide?
Yes, CoreyChem provides custom synthesis services for 4-(naphthalen-2-ylmethyl)-5H-1,2,3,5-oxathiadiazole 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.