2-Pyrrolidin-2-yl-1,3-benzoxazole
TL;DR: 2-Pyrrolidin-2-yl-1,3-benzoxazole (CAS 885461-58-5) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyrrolidin-2-yl-1,3-benzoxazole
Also Known As: 2-pyrrolidin-2-yl-1,3-benzoxazole, 2-(pyrrolidin-2-yl)-1,3-benzoxazole, 2-pyrrolidin-2-ylbenzooxazole, 2-(Pyrrolidin-2-yl)benzo[d]oxazole
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 2.2523 |
| Topological Polar Surface Area | 38.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 410.2392 |
Chemical Identifiers
| CAS Number | 885461-58-5 |
|---|---|
| SMILES | C1CC(NC1)C2=NC3=CC=CC=C3O2 |
Product Overview
2-Pyrrolidin-2-yl-1,3-benzoxazole (CAS 885461-58-5), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: 2-pyrrolidin-2-yl-1,3-benzoxazole.
Chemical Property Profile of 2-Pyrrolidin-2-yl-1,3-benzoxazole
Property Insights of 2-Pyrrolidin-2-yl-1,3-benzoxazole
The XLogP value of 2.2523 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidin-2-yl-1,3-benzoxazole. With a topological polar surface area (TPSA) of 38.06 Ų, 2-Pyrrolidin-2-yl-1,3-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidin-2-yl-1,3-benzoxazole has 1 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 2-Pyrrolidin-2-yl-1,3-benzoxazole?
The CAS number of 2-Pyrrolidin-2-yl-1,3-benzoxazole is 885461-58-5.
What is the molecular formula of 2-Pyrrolidin-2-yl-1,3-benzoxazole?
The molecular formula of 2-Pyrrolidin-2-yl-1,3-benzoxazole is C11H12N2O.
What is the molecular weight of 2-Pyrrolidin-2-yl-1,3-benzoxazole?
The molecular weight of 2-Pyrrolidin-2-yl-1,3-benzoxazole is 188.09 g/mol.
Where can I buy 2-Pyrrolidin-2-yl-1,3-benzoxazole?
You can request a quote for 2-Pyrrolidin-2-yl-1,3-benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidin-2-yl-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidin-2-yl-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.