Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate
TL;DR: Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate (CAS 16135-30-1) is a chemical compound with molecular formula C12H9NO3S and molecular weight 247.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate
Also Known As: Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate, 6-methoxycarbonyl-2-phenyl-4H-1,3-thiazine-4-one
| Molecular Formula | C12H9NO3S |
|---|---|
| Molecular Weight | 247.03 g/mol |
| LogP | 1.9569 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.03032 |
| Heavy Atoms | 17 |
| Complexity | 592.19977 |
Chemical Identifiers
| CAS Number | 16135-30-1 |
|---|---|
| SMILES | COC(=O)C1=CC(=O)N=C(S1)C2=CC=CC=C2 |
Product Overview
Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate (CAS 16135-30-1), with molecular formula C12H9NO3S and molecular weight 247.03 g/mol. IUPAC: methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate.
Chemical Property Profile of Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate
Property Insights of Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate
The XLogP value of 1.9569 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate. With a topological polar surface area (TPSA) of 56.26 Ų, Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate 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 Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate?
The CAS number of Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate is 16135-30-1.
What is the molecular formula of Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate?
The molecular formula of Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate is C12H9NO3S.
What is the molecular weight of Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate?
The molecular weight of Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate is 247.03 g/mol.
Where can I buy Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate?
You can request a quote for Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-oxo-2-phenyl-1,3-thiazine-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.