Prodiamine
TL;DR: Prodiamine (CAS 29091-21-2) is a chemical compound with molecular formula C13H17F3N4O4 and molecular weight 350.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dinitro-3-N,3-N-dipropyl-6-(trifluoromethyl)benzene-1,3-diamine
Also Known As: Prodiamine, Barricade, Rydex, Endurance, Kusablock
| Molecular Formula | C13H17F3N4O4 |
|---|---|
| Molecular Weight | 350.12 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.12018 |
| Heavy Atoms | 24 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 29091-21-2 |
|---|---|
| SMILES | CCCN(CCC)C1=C(C=C(C(=C1[N+](=O)[O-])N)C(F)(F)F)[N+](=O)[O-] |
| InChIKey | RSVPPPHXAASNOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Prodiamine (CAS 29091-21-2), with molecular formula C13H17F3N4O4 and molecular weight 350.12 g/mol. IUPAC: 2,4-dinitro-3-N,3-N-dipropyl-6-(trifluoromethyl)benzene-1,3-diamine.
Chemical Property Profile of Prodiamine
Property Insights of Prodiamine
The XLogP value of 4.2 indicates that Prodiamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Prodiamine. Following Lipinski's Rule of Five, Prodiamine has 1 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 Prodiamine?
The CAS number of Prodiamine is 29091-21-2.
What is the molecular formula of Prodiamine?
The molecular formula of Prodiamine is C13H17F3N4O4.
What is the molecular weight of Prodiamine?
The molecular weight of Prodiamine is 350.12 g/mol.
Where can I buy Prodiamine?
You can request a quote for Prodiamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prodiamine?
Yes, KEHONG BIO provides custom synthesis services for Prodiamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.