![2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one structure](/static/products/3758/375831-57-5.webp)
2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one
TL;DR: 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one (CAS 375831-57-5) is a chemical compound with molecular formula C15H12N2OS and molecular weight 268.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylanilino)-3,1-benzothiazin-4-one
Also Known As: BAS 02998702, 2-(4-methylanilino)-3,1-benzothiazin-4-one, 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one, 2-p-Tolylamino-benzo[d][1,3]thiazin-4-one, J3.647.967A
| Molecular Formula | C15H12N2OS |
|---|---|
| Molecular Weight | 268.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.06705 |
| Heavy Atoms | 19 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 375831-57-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=NC3=CC=CC=C3C(=O)S2 |
| InChIKey | XCUHWYYHTLENLP-UHFFFAOYSA-N |
Product Overview
2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one (CAS 375831-57-5), with molecular formula C15H12N2OS and molecular weight 268.07 g/mol. IUPAC: 2-(4-methylanilino)-3,1-benzothiazin-4-one.
Chemical Property Profile of 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one
Property Insights of 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one
The XLogP value of 3.6 indicates that 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one. Following Lipinski's Rule of Five, 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one has 1 hydrogen bond donor(s) and 3 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-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one?
The CAS number of 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one is 375831-57-5.
What is the molecular formula of 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one?
The molecular formula of 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one is C15H12N2OS.
What is the molecular weight of 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one?
The molecular weight of 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one is 268.07 g/mol.
Where can I buy 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one?
You can request a quote for 2-[(4-methylphenyl)amino]-4H-3,1-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-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-methylphenyl)amino]-4H-3,1-benzothiazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.