Bionet1_003743
TL;DR: Bionet1_003743 (CAS 478081-63-9) is a chemical compound with molecular formula C20H13FN2O2S2 and molecular weight 396.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-benzoyl-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylthiophene-3-carbonitrile
Also Known As: Bionet1_003743, 4-amino-5-benzoyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-thiophenecarbonitrile, 8P-395S, 4-amino-5-benzoyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}thiophene-3-carbonitrile, 4-amino-5-benzoyl-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylthiophene-3-carbonitrile
| Molecular Formula | C20H13FN2O2S2 |
|---|---|
| Molecular Weight | 396.04 g/mol |
| LogP | 4.54708 |
| Topological Polar Surface Area | 83.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.04025 |
| Heavy Atoms | 27 |
| Complexity | 1038.3389 |
Chemical Identifiers
| CAS Number | 478081-63-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=C(C(=C(S2)SCC(=O)C3=CC=C(C=C3)F)C#N)N |
Product Overview
Bionet1_003743 (CAS 478081-63-9), with molecular formula C20H13FN2O2S2 and molecular weight 396.04 g/mol. IUPAC: 4-amino-5-benzoyl-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylthiophene-3-carbonitrile.
Chemical Property Profile of Bionet1_003743
Property Insights of Bionet1_003743
The XLogP value of 4.54708 indicates that Bionet1_003743 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.95 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_003743. Following Lipinski's Rule of Five, Bionet1_003743 has 1 hydrogen bond donor(s) and 6 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_003743?
The CAS number of Bionet1_003743 is 478081-63-9.
What is the molecular formula of Bionet1_003743?
The molecular formula of Bionet1_003743 is C20H13FN2O2S2.
What is the molecular weight of Bionet1_003743?
The molecular weight of Bionet1_003743 is 396.04 g/mol.
Where can I buy Bionet1_003743?
You can request a quote for Bionet1_003743 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003743?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003743 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.