Bionet1_004804
TL;DR: Bionet1_004804 (CAS 439109-68-9) is a chemical compound with molecular formula C19H17F3N4O2 and molecular weight 390.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-imidazol-1-ylpropyl)-4-[4-(trifluoromethyl)benzoyl]-1H-pyrrole-2-carboxamide
Also Known As: Bionet1_004804, N-[3-(1H-imidazol-1-yl)propyl]-4-[4-(trifluoromethyl)benzoyl]-1H-pyrrole-2-carboxamide, N-(3-imidazol-1-ylpropyl)-4-[4-(trifluoromethyl)benzoyl]-1H-pyrrole-2-carboxamide
| Molecular Formula | C19H17F3N4O2 |
|---|---|
| Molecular Weight | 390.13 g/mol |
| LogP | 3.2811 |
| Topological Polar Surface Area | 79.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.13037 |
| Heavy Atoms | 28 |
| Complexity | 944.4765 |
Chemical Identifiers
| CAS Number | 439109-68-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C2=CNC(=C2)C(=O)NCCCN3C=CN=C3)C(F)(F)F |
Product Overview
Bionet1_004804 (CAS 439109-68-9), with molecular formula C19H17F3N4O2 and molecular weight 390.13 g/mol. IUPAC: N-(3-imidazol-1-ylpropyl)-4-[4-(trifluoromethyl)benzoyl]-1H-pyrrole-2-carboxamide.
Chemical Property Profile of Bionet1_004804
Property Insights of Bionet1_004804
The XLogP value of 3.2811 indicates that Bionet1_004804 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004804. Following Lipinski's Rule of Five, Bionet1_004804 has 2 hydrogen bond donor(s) and 3 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 Bionet1_004804?
The CAS number of Bionet1_004804 is 439109-68-9.
What is the molecular formula of Bionet1_004804?
The molecular formula of Bionet1_004804 is C19H17F3N4O2.
What is the molecular weight of Bionet1_004804?
The molecular weight of Bionet1_004804 is 390.13 g/mol.
Where can I buy Bionet1_004804?
You can request a quote for Bionet1_004804 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004804?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004804 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.