2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile
TL;DR: 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile (CAS 720670-19-9) is a chemical compound with molecular formula C15H15N3O and molecular weight 253.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile
Also Known As: AB00361932-08, 2-benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile, AF-399/42762003, 2-benzyl-5-(1-pyrrolidinyl)-1,3-oxazole-4-carbonitrile, 2-benzyl-5-pyrrolidinyl-1,3-oxazole-4-carbonitrile
| Molecular Formula | C15H15N3O |
|---|---|
| Molecular Weight | 253.12 g/mol |
| LogP | 2.73728 |
| Topological Polar Surface Area | 53.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.1215 |
| Heavy Atoms | 19 |
| Complexity | 591.5984 |
Chemical Identifiers
| CAS Number | 720670-19-9 |
|---|---|
| SMILES | C1CCN(C1)C2=C(N=C(O2)CC3=CC=CC=C3)C#N |
Product Overview
2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile (CAS 720670-19-9), with molecular formula C15H15N3O and molecular weight 253.12 g/mol. IUPAC: 2-benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile
Property Insights of 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile
The XLogP value of 2.73728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile. With a topological polar surface area (TPSA) of 53.06 Ų, 2-Benzyl-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-Benzyl-5-pyrrolidin-1-yl-1,3-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-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile?
The CAS number of 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile is 720670-19-9.
What is the molecular formula of 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile?
The molecular formula of 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile is C15H15N3O.
What is the molecular weight of 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile?
The molecular weight of 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile is 253.12 g/mol.
Where can I buy 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile?
You can request a quote for 2-Benzyl-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-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-5-pyrrolidin-1-yl-1,3-oxazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.