DISPERSE RED 179
TL;DR: DISPERSE RED 179 (CAS 16586-42-8) is a chemical compound with molecular formula C19H18N6O2S and molecular weight 394.1212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[N-ethyl-3-methyl-4-[(6-nitro-1,3-benzothiazol-2-yl)diazenyl]anilino]propanenitrile
Also Known As: DISPERSE RED 179, C.I. Disperse Red 179, Rubine S-2BL, CI Disperse Red 179, C.I. Disperse Violet 52
Technical Specifications
| Molecular Formula | C19H18N6O2S |
| Molecular Weight | 394.1212 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 139.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.1212 Da |
| Heavy Atoms | 28 |
| Complexity | 617.0 |
| SMILES | CCN(CCC#N)C1=CC(=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C |
| InChIKey | WYHKEXCMJQVTSP-UHFFFAOYSA-N |
Chemical Property Profile of DISPERSE RED 179
Property Insights of DISPERSE RED 179
The XLogP value of 4.9 indicates that DISPERSE RED 179 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for DISPERSE RED 179. Following Lipinski's Rule of Five, DISPERSE RED 179 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of DISPERSE RED 179?
The CAS number of DISPERSE RED 179 is 16586-42-8.
What is the molecular formula of DISPERSE RED 179?
The molecular formula of DISPERSE RED 179 is C19H18N6O2S.
What is the molecular weight of DISPERSE RED 179?
The molecular weight of DISPERSE RED 179 is 394.1212 g/mol.
Where can I buy DISPERSE RED 179?
You can request a quote for DISPERSE RED 179 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for DISPERSE RED 179?
Yes, CoreyChem provides custom synthesis services for DISPERSE RED 179 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.