![(Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one structure](/static/products/312/312946-34-2.png)
(Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one
TL;DR: (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one (CAS 312946-34-2) is a chemical compound with molecular formula C16H11NO3S and molecular weight 297.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-(3-oxo-1-benzothiophen-2-ylidene)amino] 4-methylbenzoate
Also Known As: (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one, [(Z)-(3-oxo-1-benzothiophen-2-ylidene)amino] 4-methylbenzoate, (2Z)-2-({[(4-methylphenyl)carbonyl]oxy}imino)-1-benzothiophen-3(2H)-one, [(2Z)-3-OXO-2,3-DIHYDRO-1-BENZOTHIOPHEN-2-YLIDENE]AMINO 4-METHYLBENZOATE
| Molecular Formula | C16H11NO3S |
|---|---|
| Molecular Weight | 297.05 g/mol |
| LogP | 3.45392 |
| Topological Polar Surface Area | 55.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.04596 |
| Heavy Atoms | 21 |
| Complexity | 750.3723 |
Chemical Identifiers
| CAS Number | 312946-34-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)O/N=C\2/C(=O)C3=CC=CC=C3S2 |
Product Overview
(Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one (CAS 312946-34-2), with molecular formula C16H11NO3S and molecular weight 297.05 g/mol. IUPAC: [(Z)-(3-oxo-1-benzothiophen-2-ylidene)amino] 4-methylbenzoate.
Chemical Property Profile of (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one
Property Insights of (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one
The XLogP value of 3.45392 indicates that (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.73 Ų, (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one 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 (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one?
The CAS number of (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one is 312946-34-2.
What is the molecular formula of (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one?
The molecular formula of (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one is C16H11NO3S.
What is the molecular weight of (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one?
The molecular weight of (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one is 297.05 g/mol.
Where can I buy (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one?
You can request a quote for (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(((4-methylbenzoyl)oxy)imino)benzo[b]thiophen-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.