2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline
TL;DR: 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline (CAS 33174-93-5) is a chemical compound with molecular formula C10H9BrN4S and molecular weight 295.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-bromophenyl)diazenyl]-4-methyl-1,3-thiazol-2-amine
Also Known As: NCI60_000852, 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline, 2-bromo-N-[(E)-(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino, (5Z)-5-[2-(2-Bromophenyl)hydrazinylidene]-4-methyl-1,3-thiazol-2(5H)-imine
| Molecular Formula | C10H9BrN4S |
|---|---|
| Molecular Weight | 295.97 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.97314 |
| Heavy Atoms | 16 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 33174-93-5 |
|---|---|
| SMILES | CC1=C(SC(=N1)N)N=NC2=CC=CC=C2Br |
| InChIKey | KBPPJJJWOGWJHT-UHFFFAOYSA-N |
Product Overview
2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline (CAS 33174-93-5), with molecular formula C10H9BrN4S and molecular weight 295.97 g/mol. IUPAC: 5-[(2-bromophenyl)diazenyl]-4-methyl-1,3-thiazol-2-amine.
Chemical Property Profile of 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline
Property Insights of 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline
The XLogP value of 3.8 indicates that 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline. Following Lipinski's Rule of Five, 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline has 1 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 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline?
The CAS number of 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline is 33174-93-5.
What is the molecular formula of 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline?
The molecular formula of 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline is C10H9BrN4S.
What is the molecular weight of 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline?
The molecular weight of 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline is 295.97 g/mol.
Where can I buy 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline?
You can request a quote for 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-bromo-N-[(2-imino-4-methyl-1,3-thiazol-5-ylidene)amino]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.