4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole
TL;DR: 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole (CAS 149065-75-8) is a chemical compound with molecular formula C14H13NOS and molecular weight 243.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-2-thiophen-2-yl-4,5-dihydro-1,3-oxazole
Also Known As: NCI60_024502, 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole, 4-benzyl-2-(2-thienyl)-4,5-dihydrooxazole, 4-benzyl-4,5-dihydro-2-(thiophen-2-yl) oxazole, (S)-4-Benzyl-2-(thiophen-2-yl)-4,5-dihydrooxazole
| Molecular Formula | C14H13NOS |
|---|---|
| Molecular Weight | 243.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.0718 |
| Heavy Atoms | 17 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 149065-75-8 |
|---|---|
| SMILES | C1C(N=C(O1)C2=CC=CS2)CC3=CC=CC=C3 |
| InChIKey | QKICIDWWVZZURL-UHFFFAOYSA-N |
Product Overview
4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole (CAS 149065-75-8), with molecular formula C14H13NOS and molecular weight 243.07 g/mol. IUPAC: 4-benzyl-2-thiophen-2-yl-4,5-dihydro-1,3-oxazole.
Chemical Property Profile of 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole
Property Insights of 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole
The XLogP value of 3.5 indicates that 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole has 0 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 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole?
The CAS number of 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole is 149065-75-8.
What is the molecular formula of 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole?
The molecular formula of 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole is C14H13NOS.
What is the molecular weight of 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole?
The molecular weight of 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole is 243.07 g/mol.
Where can I buy 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole?
You can request a quote for 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyl-2-(2-thienyl)-4,5-dihydro-1,3-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.