Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)-
TL;DR: Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- (CAS 30822-65-2) is a chemical compound with molecular formula C14H11NO2S and molecular weight 257.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl (1Z)-N-hydroxy-2-oxo-2-phenylethanimidothioate
Also Known As: 2-Phenylthioglyoxilohydroximic acid S-phenyl ester, Glyoxilohydroximic acid, 2-phenylthio-, S-phenyl ester, J1.178.819J, Benzeneethanimidothioic acid, N-hydroxy-alpha-oxo-, phenyl ester, Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)-
| Molecular Formula | C14H11NO2S |
|---|---|
| Molecular Weight | 257.05 g/mol |
| LogP | 3.4493 |
| Topological Polar Surface Area | 49.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.05106 |
| Heavy Atoms | 18 |
| Complexity | 552.52136 |
Chemical Identifiers
| CAS Number | 30822-65-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)/C(=N/O)/SC2=CC=CC=C2 |
Product Overview
Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- (CAS 30822-65-2), with molecular formula C14H11NO2S and molecular weight 257.05 g/mol. IUPAC: phenyl (1Z)-N-hydroxy-2-oxo-2-phenylethanimidothioate.
Chemical Property Profile of Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)-
Property Insights of Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)-
The XLogP value of 3.4493 indicates that Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.66 Ų, Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- has 1 hydrogen bond donor(s) and 4 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 Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)-?
The CAS number of Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- is 30822-65-2.
What is the molecular formula of Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)-?
The molecular formula of Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- is C14H11NO2S.
What is the molecular weight of Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)-?
The molecular weight of Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- is 257.05 g/mol.
Where can I buy Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)-?
You can request a quote for Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanimidothioicacid, N-hydroxy-a-oxo-, phenyl ester, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.