![2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide structure](/static/products/1317/131729-17-4.webp)
2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide
TL;DR: 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide (CAS 131729-17-4) is a chemical compound with molecular formula C12H10BrNO2S and molecular weight 310.96155 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-bromoethyl)-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene 2,2-dioxide
Also Known As: Ciapilome, 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide, 2H-Naphth[1,8-cd]isothiazole, 2-(2-bromoethyl)-, 1,1-dioxide, 8-(CHLOROMETHYL)-6-FLUOROBENZO-1,3-DIOXANE, 2H-Naphth[1,8-cd]isothiazole,2-(2-bromoethyl)-, 1,1-dioxide
Technical Specifications
| Molecular Formula | C12H10BrNO2S |
| Molecular Weight | 310.96155 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.96155 Da |
| Heavy Atoms | 17 |
| Complexity | 392.0 |
| SMILES | C1=CC2=C3C(=C1)N(S(=O)(=O)C3=CC=C2)CCBr |
| InChIKey | RFBNGWPBQUOUNT-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide
Property Insights of 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide. With a topological polar surface area (TPSA) of 45.8 Ų, 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide?
The CAS number of 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide is 131729-17-4.
What is the molecular formula of 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide?
The molecular formula of 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide is C12H10BrNO2S.
What is the molecular weight of 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide?
The molecular weight of 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide is 310.96155 g/mol.
Where can I buy 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide?
You can request a quote for 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide?
Yes, CoreyChem provides custom synthesis services for 2-(2-bromoethyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.