Bionet1_002649
TL;DR: Bionet1_002649 (CAS 339099-53-5) is a chemical compound with molecular formula C17H15ClF3N3O2 and molecular weight 385.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoyl]-N-prop-2-enyl-1H-pyrrole-2-carboxamide
Also Known As: Bionet1_002649, N-allyl-4-{2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoyl}-1H-pyrrole-2-carboxamide, 4-{2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanoyl}-N-(prop-2-en-1-yl)-1H-pyrrole-2-carboxamide, 4-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanoyl]-N-prop-2-enyl-1H-pyrrole-2-carboxamide, N-allyl-4-(2-(3-chloro-5-(trifluoromethyl)-2-pyridinyl)propanoyl)-1H-pyrrole-2-carboxamide
| Molecular Formula | C17H15ClF3N3O2 |
|---|---|
| Molecular Weight | 385.08 g/mol |
| LogP | 3.9841 |
| Topological Polar Surface Area | 74.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.08047 |
| Heavy Atoms | 26 |
| Complexity | 846.0189 |
Chemical Identifiers
| CAS Number | 339099-53-5 |
|---|---|
| SMILES | CC(C1=C(C=C(C=N1)C(F)(F)F)Cl)C(=O)C2=CNC(=C2)C(=O)NCC=C |
Product Overview
Bionet1_002649 (CAS 339099-53-5), with molecular formula C17H15ClF3N3O2 and molecular weight 385.08 g/mol. IUPAC: 4-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoyl]-N-prop-2-enyl-1H-pyrrole-2-carboxamide.
Chemical Property Profile of Bionet1_002649
Property Insights of Bionet1_002649
The XLogP value of 3.9841 indicates that Bionet1_002649 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002649. Following Lipinski's Rule of Five, Bionet1_002649 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_002649?
The CAS number of Bionet1_002649 is 339099-53-5.
What is the molecular formula of Bionet1_002649?
The molecular formula of Bionet1_002649 is C17H15ClF3N3O2.
What is the molecular weight of Bionet1_002649?
The molecular weight of Bionet1_002649 is 385.08 g/mol.
Where can I buy Bionet1_002649?
You can request a quote for Bionet1_002649 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002649?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002649 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.