2-Phenyl-4H-1,3-benzothiazin-4-one
TL;DR: 2-Phenyl-4H-1,3-benzothiazin-4-one (CAS 7474-08-0) is a chemical compound with molecular formula C14H9NOS and molecular weight 239.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-1,3-benzothiazin-4-one
Also Known As: 2-Phenyl-4H-1,3-benzothiazin-4-one, 2-phenyl-1,3-benzothiazin-4-one, 2-Phenyl-4H-1,3-benzthiazin-4-on, RefChem:265281, Cambridge id 5549187
| Molecular Formula | C14H9NOS |
|---|---|
| Molecular Weight | 239.04 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.04048 |
| Heavy Atoms | 17 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 7474-08-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=O)C3=CC=CC=C3S2 |
| InChIKey | XENUZRFQWYUPEZ-UHFFFAOYSA-N |
Product Overview
2-Phenyl-4H-1,3-benzothiazin-4-one (CAS 7474-08-0), with molecular formula C14H9NOS and molecular weight 239.04 g/mol. IUPAC: 2-phenyl-1,3-benzothiazin-4-one.
Chemical Property Profile of 2-Phenyl-4H-1,3-benzothiazin-4-one
Property Insights of 2-Phenyl-4H-1,3-benzothiazin-4-one
The XLogP value of 3.5 indicates that 2-Phenyl-4H-1,3-benzothiazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.7 Ų, 2-Phenyl-4H-1,3-benzothiazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenyl-4H-1,3-benzothiazin-4-one has 0 hydrogen bond donor(s) and 2 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 2-Phenyl-4H-1,3-benzothiazin-4-one?
The CAS number of 2-Phenyl-4H-1,3-benzothiazin-4-one is 7474-08-0.
What is the molecular formula of 2-Phenyl-4H-1,3-benzothiazin-4-one?
The molecular formula of 2-Phenyl-4H-1,3-benzothiazin-4-one is C14H9NOS.
What is the molecular weight of 2-Phenyl-4H-1,3-benzothiazin-4-one?
The molecular weight of 2-Phenyl-4H-1,3-benzothiazin-4-one is 239.04 g/mol.
Where can I buy 2-Phenyl-4H-1,3-benzothiazin-4-one?
You can request a quote for 2-Phenyl-4H-1,3-benzothiazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenyl-4H-1,3-benzothiazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenyl-4H-1,3-benzothiazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.