Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-
TL;DR: Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)- (CAS 108176-70-1) is a chemical compound with molecular formula C17H17N3OS and molecular weight 311.10922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2H-1,4-benzothiazin-3-yl)-3-(2,6-dimethylphenyl)urea
Also Known As: Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-, N-2H-1,4-Benzothiazin-3-yl-N'-(2,6-dimethylphenyl)urea, 1-(2H-1,4-benzothiazin-3-yl)-3-(2,6-dimethylphenyl)urea, N-(2H-1,4-Benzothiazin-3-yl)-N'-(2,6-dimethylphenyl)urea, BRN 5606661
Technical Specifications
| Molecular Formula | C17H17N3OS |
| Molecular Weight | 311.10922 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 78.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 311.10922 Da |
| Heavy Atoms | 22 |
| Complexity | 430.0 |
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)NC2=NC3=CC=CC=C3SC2 |
| InChIKey | HNAJGGNAEGWRJA-UHFFFAOYSA-N |
Chemical Property Profile of Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-
Property Insights of Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-
The XLogP value of 3.4 indicates that Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-. Following Lipinski's Rule of Five, Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-?
The CAS number of Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)- is 108176-70-1.
What is the molecular formula of Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-?
The molecular formula of Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)- is C17H17N3OS.
What is the molecular weight of Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-?
The molecular weight of Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)- is 311.10922 g/mol.
Where can I buy Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-?
You can request a quote for Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)-?
Yes, CoreyChem provides custom synthesis services for Urea, N-2H-1,4-benzothiazin-3-yl-N'-(2,6-dimethylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.