![3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one structure](/static/products/5315/5315-73-1.webp)
3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one
TL;DR: 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one (CAS 5315-73-1) is a chemical compound with molecular formula C18H18N2O2S and molecular weight 326.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-1-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]butan-2-one
Also Known As: 3,3-dimethyl-1-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]butan-2-one, 3,3-dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one
| Molecular Formula | C18H18N2O2S |
|---|---|
| Molecular Weight | 326.11 g/mol |
| LogP | 4.5971 |
| Topological Polar Surface Area | 55.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.1089 |
| Heavy Atoms | 23 |
| Complexity | 849.34894 |
Chemical Identifiers
| CAS Number | 5315-73-1 |
|---|---|
| SMILES | CC(C)(C)C(=O)CSC1=NN=C(O1)C2=CC3=CC=CC=C3C=C2 |
Product Overview
3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one (CAS 5315-73-1), with molecular formula C18H18N2O2S and molecular weight 326.11 g/mol. IUPAC: 3,3-dimethyl-1-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]butan-2-one.
Chemical Property Profile of 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one
Property Insights of 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one
The XLogP value of 4.5971 indicates that 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.99 Ų, 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one 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 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one?
The CAS number of 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one is 5315-73-1.
What is the molecular formula of 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one?
The molecular formula of 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one is C18H18N2O2S.
What is the molecular weight of 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one?
The molecular weight of 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one is 326.11 g/mol.
Where can I buy 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one?
You can request a quote for 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-1-{[5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.