BAS 04370872
TL;DR: BAS 04370872 (CAS 459846-49-2) is a chemical compound with molecular formula C16H18FN3O2S and molecular weight 335.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(2-methylpiperidin-1-yl)ethanone
Also Known As: BAS 04370872, 2-{[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(2-methylpiperidin-1-yl)ethan-1-one, 2-((5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl)thio)-1-(2-methylpiperidin-1-yl)ethanone, 2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(2-methylpiperidin-1-yl)ethanone, 2-[5-(2-fluorophenyl)(1,3,4-oxadiazol-2-ylthio)]-1-(2-methylpiperidyl)ethan-1- one
| Molecular Formula | C16H18FN3O2S |
|---|---|
| Molecular Weight | 335.11 g/mol |
| LogP | 3.3688 |
| Topological Polar Surface Area | 59.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.11038 |
| Heavy Atoms | 23 |
| Complexity | 691.4698 |
Chemical Identifiers
| CAS Number | 459846-49-2 |
|---|---|
| SMILES | CC1CCCCN1C(=O)CSC2=NN=C(O2)C3=CC=CC=C3F |
Product Overview
BAS 04370872 (CAS 459846-49-2), with molecular formula C16H18FN3O2S and molecular weight 335.11 g/mol. IUPAC: 2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(2-methylpiperidin-1-yl)ethanone.
Chemical Property Profile of BAS 04370872
Property Insights of BAS 04370872
The XLogP value of 3.3688 indicates that BAS 04370872 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.23 Ų, BAS 04370872 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04370872 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 BAS 04370872?
The CAS number of BAS 04370872 is 459846-49-2.
What is the molecular formula of BAS 04370872?
The molecular formula of BAS 04370872 is C16H18FN3O2S.
What is the molecular weight of BAS 04370872?
The molecular weight of BAS 04370872 is 335.11 g/mol.
Where can I buy BAS 04370872?
You can request a quote for BAS 04370872 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04370872?
Yes, KEHONG BIO provides custom synthesis services for BAS 04370872 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.