AB00740096-01
TL;DR: AB00740096-01 (CAS 556040-36-9) is a chemical compound with molecular formula C21H20FN3O4S2 and molecular weight 461.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-2-[[5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
Also Known As: AB00740096-01, F3301-0037, 1-(4-fluorophenyl)-2-({5-[3-(piperidine-1-sulfonyl)phenyl]-1,3,4-oxadiazol-2-yl}sulfanyl)ethan-1-one, 1-(4-fluorophenyl)-2-((5-(3-(piperidin-1-ylsulfonyl)phenyl)-1,3,4-oxadiazol-2-yl)thio)ethanone, 1-(4-fluorophenyl)-2-[[5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
| Molecular Formula | C21H20FN3O4S2 |
|---|---|
| Molecular Weight | 461.09 g/mol |
| LogP | 4.0253 |
| Topological Polar Surface Area | 93.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.08792 |
| Heavy Atoms | 31 |
| Complexity | 1173.3453 |
Chemical Identifiers
| CAS Number | 556040-36-9 |
|---|---|
| SMILES | C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCC(=O)C4=CC=C(C=C4)F |
Product Overview
AB00740096-01 (CAS 556040-36-9), with molecular formula C21H20FN3O4S2 and molecular weight 461.09 g/mol. IUPAC: 1-(4-fluorophenyl)-2-[[5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone.
Chemical Property Profile of AB00740096-01
Property Insights of AB00740096-01
The XLogP value of 4.0253 indicates that AB00740096-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.37 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00740096-01. Following Lipinski's Rule of Five, AB00740096-01 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
Frequently Asked Questions
What is the CAS number of AB00740096-01?
The CAS number of AB00740096-01 is 556040-36-9.
What is the molecular formula of AB00740096-01?
The molecular formula of AB00740096-01 is C21H20FN3O4S2.
What is the molecular weight of AB00740096-01?
The molecular weight of AB00740096-01 is 461.09 g/mol.
Where can I buy AB00740096-01?
You can request a quote for AB00740096-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00740096-01?
Yes, KEHONG BIO provides custom synthesis services for AB00740096-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.