2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile
TL;DR: 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile (CAS 307326-74-5) is a chemical compound with molecular formula C14H12FN3O and molecular weight 257.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile
Also Known As: AE-641/14179168, 2-(4-fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile, 2-(4-fluorophenyl)-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile, 2-(4-fluorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile
| Molecular Formula | C14H12FN3O |
|---|---|
| Molecular Weight | 257.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.09644 |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 307326-74-5 |
|---|---|
| SMILES | C1CCN(C1)C2=C(N=C(O2)C3=CC=C(C=C3)F)C#N |
| InChIKey | JDCBDIVEQMLPBZ-UHFFFAOYSA-N |
Product Overview
2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile (CAS 307326-74-5), with molecular formula C14H12FN3O and molecular weight 257.10 g/mol. IUPAC: 2-(4-fluorophenyl)-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile
Property Insights of 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile
The XLogP value of 3.1 indicates that 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.1 Ų, 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile has 0 hydrogen bond donor(s) and 5 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 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile?
The CAS number of 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile is 307326-74-5.
What is the molecular formula of 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile?
The molecular formula of 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile is C14H12FN3O.
What is the molecular weight of 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile?
The molecular weight of 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile is 257.10 g/mol.
Where can I buy 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile?
You can request a quote for 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluorophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.