4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole
TL;DR: 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole (CAS 451469-93-5) is a chemical compound with molecular formula C13H17N3O3S and molecular weight 295.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,5-dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole
Also Known As: ChemDiv1_015242, 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole, 4-[(3,5-dimethylpiperidyl)sulfonyl]benzo[c]1,2,5-oxadiazole, 4-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2,1,3-benzoxadiazole
| Molecular Formula | C13H17N3O3S |
|---|---|
| Molecular Weight | 295.10 g/mol |
| LogP | 1.8894 |
| Topological Polar Surface Area | 76.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.09906 |
| Heavy Atoms | 20 |
| Complexity | 715.29156 |
Chemical Identifiers
| CAS Number | 451469-93-5 |
|---|---|
| SMILES | CC1CC(CN(C1)S(=O)(=O)C2=CC=CC3=NON=C32)C |
Product Overview
4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole (CAS 451469-93-5), with molecular formula C13H17N3O3S and molecular weight 295.10 g/mol. IUPAC: 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole.
Chemical Property Profile of 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole
Property Insights of 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole
The XLogP value of 1.8894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole. The TPSA of 76.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole. Following Lipinski's Rule of Five, 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole has 0 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 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole?
The CAS number of 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole is 451469-93-5.
What is the molecular formula of 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole?
The molecular formula of 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole is C13H17N3O3S.
What is the molecular weight of 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole?
The molecular weight of 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole is 295.10 g/mol.
Where can I buy 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole?
You can request a quote for 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,5-Dimethylpiperidin-1-yl)sulfonyl-2,1,3-benzoxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.