Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)-
TL;DR: Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- (CAS 108176-80-3) is a chemical compound with molecular formula C18H19N3OS and molecular weight 325.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-1-(2,6-dimethylphenyl)-3-(4-methyl-1,4-benzothiazin-3-ylidene)urea
Also Known As: (2,6-Dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)urea, Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)-, (3Z)-1-(2,6-dimethylphenyl)-3-(4-methyl-1,4-benzothiazin-3-ylidene)urea, RefChem:1100674
| Molecular Formula | C18H19N3OS |
|---|---|
| Molecular Weight | 325.12 g/mol |
| LogP | 4.47594 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 325.12488 |
| Heavy Atoms | 23 |
| Complexity | 765.3362 |
Chemical Identifiers
| CAS Number | 108176-80-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)/N=C\2/CSC3=CC=CC=C3N2C |
Product Overview
Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- (CAS 108176-80-3), with molecular formula C18H19N3OS and molecular weight 325.12 g/mol. IUPAC: (3Z)-1-(2,6-dimethylphenyl)-3-(4-methyl-1,4-benzothiazin-3-ylidene)urea.
Chemical Property Profile of Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)-
Property Insights of Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)-
The XLogP value of 4.47594 indicates that Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- has 1 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 Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)-?
The CAS number of Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- is 108176-80-3.
What is the molecular formula of Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)-?
The molecular formula of Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- is C18H19N3OS.
What is the molecular weight of Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)-?
The molecular weight of Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- is 325.12 g/mol.
Where can I buy Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)-?
You can request a quote for Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, (2,6-dimethylphenyl)(4-methyl-2H-1,4-benzothiazin-3(4H)-ylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.