Bionet1_001604
TL;DR: Bionet1_001604 (CAS 338397-77-6) is a chemical compound with molecular formula C19H11ClF3N3O and molecular weight 389.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-(2-phenylacetyl)pyrrole-2-carbonitrile
Also Known As: Bionet1_001604, 2H-048, 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-(2-phenylacetyl)-1H-pyrrole-2-carbonitrile, 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-(2-phenylacetyl)-1H-pyrrole-2-carbonitrile, 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-(2-phenylacetyl)pyrrole-2-carbonitrile
| Molecular Formula | C19H11ClF3N3O |
|---|---|
| Molecular Weight | 389.05 g/mol |
| LogP | 4.84158 |
| Topological Polar Surface Area | 58.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.05426 |
| Heavy Atoms | 27 |
| Complexity | 1036.5889 |
Chemical Identifiers
| CAS Number | 338397-77-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)C2=CN(C(=C2)C#N)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
Bionet1_001604 (CAS 338397-77-6), with molecular formula C19H11ClF3N3O and molecular weight 389.05 g/mol. IUPAC: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-(2-phenylacetyl)pyrrole-2-carbonitrile.
Chemical Property Profile of Bionet1_001604
Property Insights of Bionet1_001604
The XLogP value of 4.84158 indicates that Bionet1_001604 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.68 Ų, Bionet1_001604 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_001604 has 0 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_001604?
The CAS number of Bionet1_001604 is 338397-77-6.
What is the molecular formula of Bionet1_001604?
The molecular formula of Bionet1_001604 is C19H11ClF3N3O.
What is the molecular weight of Bionet1_001604?
The molecular weight of Bionet1_001604 is 389.05 g/mol.
Where can I buy Bionet1_001604?
You can request a quote for Bionet1_001604 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_001604?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_001604 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.