BAS 04392639
TL;DR: BAS 04392639 (CAS 460728-14-7) is a chemical compound with molecular formula C16H19N3O4S and molecular weight 349.10962 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-ylethanone
Also Known As: BAS 04392639, F0594-0471, 2-{[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethan-1-one, 2-((5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl)thio)-1-(pyrrolidin-1-yl)ethanone, 2-[[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-ylethanone
Technical Specifications
| Molecular Formula | C16H19N3O4S |
| Molecular Weight | 349.10962 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.10962 Da |
| Heavy Atoms | 24 |
| Complexity | 410.0 |
| SMILES | COC1=CC(=CC(=C1)C2=NN=C(O2)SCC(=O)N3CCCC3)OC |
| InChIKey | LXQFLPYOCAMZAR-UHFFFAOYSA-N |
Chemical Property Profile of BAS 04392639
Property Insights of BAS 04392639
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04392639. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04392639. Following Lipinski's Rule of Five, BAS 04392639 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BAS 04392639?
The CAS number of BAS 04392639 is 460728-14-7.
What is the molecular formula of BAS 04392639?
The molecular formula of BAS 04392639 is C16H19N3O4S.
What is the molecular weight of BAS 04392639?
The molecular weight of BAS 04392639 is 349.10962 g/mol.
Where can I buy BAS 04392639?
You can request a quote for BAS 04392639 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 04392639?
Yes, CoreyChem provides custom synthesis services for BAS 04392639 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.