2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile
TL;DR: 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile (CAS 613651-72-2) is a chemical compound with molecular formula C14H12ClN3O and molecular weight 273.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chlorophenyl)-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile
Also Known As: IFLab1_004777, AMS_CNC_ID-320415390, IDI1_010532, AB00324468-02, 2-(2-chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile
| Molecular Formula | C14H12ClN3O |
|---|---|
| Molecular Weight | 273.07 g/mol |
| LogP | 3.46688 |
| Topological Polar Surface Area | 53.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.0669 |
| Heavy Atoms | 19 |
| Complexity | 638.3809 |
Chemical Identifiers
| CAS Number | 613651-72-2 |
|---|---|
| SMILES | C1CCN(C1)C2=C(N=C(O2)C3=CC=CC=C3Cl)C#N |
Product Overview
2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile (CAS 613651-72-2), with molecular formula C14H12ClN3O and molecular weight 273.07 g/mol. IUPAC: 2-(2-chlorophenyl)-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile
Property Insights of 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile
The XLogP value of 3.46688 indicates that 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.06 Ų, 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile has 0 hydrogen bond donor(s) and 4 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-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile?
The CAS number of 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile is 613651-72-2.
What is the molecular formula of 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile?
The molecular formula of 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile is C14H12ClN3O.
What is the molecular weight of 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile?
The molecular weight of 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile is 273.07 g/mol.
Where can I buy 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile?
You can request a quote for 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)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-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chlorophenyl)-5-(pyrrolidin-1-yl)oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.