Disperse Blue 148
TL;DR: Disperse Blue 148 (CAS 52239-04-0) is a chemical compound with molecular formula C19H19N5O4S and molecular weight 413.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[N-ethyl-4-[(5-nitro-2,1-benzothiazol-3-yl)diazenyl]anilino]propanoate
Also Known As: Disperse Blue 148, DisperseBlue148, Dispersion blue 148, C.I.Disperse Blue 148, C.I. Disperse Blue 148
| Molecular Formula | C19H19N5O4S |
|---|---|
| Molecular Weight | 413.12 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 413.11578 |
| Heavy Atoms | 29 |
| Complexity | 594.0 |
Chemical Identifiers
| CAS Number | 52239-04-0 |
|---|---|
| SMILES | CCN(CCC(=O)OC)C1=CC=C(C=C1)N=NC2=C3C=C(C=CC3=NS2)[N+](=O)[O-] |
| InChIKey | VHLFTCNAACYPDY-UHFFFAOYSA-N |
Product Overview
Disperse Blue 148 (CAS 52239-04-0), with molecular formula C19H19N5O4S and molecular weight 413.12 g/mol. IUPAC: methyl 3-[N-ethyl-4-[(5-nitro-2,1-benzothiazol-3-yl)diazenyl]anilino]propanoate.
Chemical Property Profile of Disperse Blue 148
Property Insights of Disperse Blue 148
The XLogP value of 4.6 indicates that Disperse Blue 148 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting Disperse Blue 148 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Disperse Blue 148 has 0 hydrogen bond donor(s) and 9 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 Disperse Blue 148?
The CAS number of Disperse Blue 148 is 52239-04-0.
What is the molecular formula of Disperse Blue 148?
The molecular formula of Disperse Blue 148 is C19H19N5O4S.
What is the molecular weight of Disperse Blue 148?
The molecular weight of Disperse Blue 148 is 413.12 g/mol.
Where can I buy Disperse Blue 148?
You can request a quote for Disperse Blue 148 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disperse Blue 148?
Yes, KEHONG BIO provides custom synthesis services for Disperse Blue 148 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.