N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide
TL;DR: N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide (CAS 354819-85-5) is a chemical compound with molecular formula C18H22FN5O2S and molecular weight 391.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(5S)-3-[4-(4-cyanopiperazin-1-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]propanethioamide
Also Known As: N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide, Propanethioamide, N-(((5S)-3-(4-(4-cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)-
| Molecular Formula | C18H22FN5O2S |
|---|---|
| Molecular Weight | 391.15 g/mol |
| LogP | 2.08098 |
| Topological Polar Surface Area | 71.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.14783 |
| Heavy Atoms | 27 |
| Complexity | 760.60913 |
Chemical Identifiers
| CAS Number | 354819-85-5 |
|---|---|
| SMILES | CCC(=S)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCN(CC3)C#N)F |
Product Overview
N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide (CAS 354819-85-5), with molecular formula C18H22FN5O2S and molecular weight 391.15 g/mol. IUPAC: N-[[(5S)-3-[4-(4-cyanopiperazin-1-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]propanethioamide.
Chemical Property Profile of N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide
Property Insights of N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide
The XLogP value of 2.08098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide. The TPSA of 71.84 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide. Following Lipinski's Rule of Five, N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide has 1 hydrogen bond donor(s) and 6 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 N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide?
The CAS number of N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide is 354819-85-5.
What is the molecular formula of N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide?
The molecular formula of N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide is C18H22FN5O2S.
What is the molecular weight of N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide?
The molecular weight of N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide is 391.15 g/mol.
Where can I buy N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide?
You can request a quote for N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(((5S)-3-(4-(4-Cyano-1-piperazinyl)-3-fluorophenyl)-2-oxo-5-oxazolidinyl)methyl)propanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.