4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole
TL;DR: 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole (CAS 906520-27-2) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methoxyphenyl)-4-propan-2-yl-4,5-dihydro-1,3-oxazole
Also Known As: NCI60_015007, 4-isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole, 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydro-1,3-oxazole, 3-(4-Isopropyl-4,5-dihydro-1,3-oxazol-2-yl)phenyl methyl ether, 2-(3-methoxyphenyl)-4-propan-2-yl-4,5-dihydro-1,3-oxazole
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 30.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 906520-27-2 |
|---|---|
| SMILES | CC(C)C1COC(=N1)C2=CC(=CC=C2)OC |
| InChIKey | SHTHIWBKEFNLPE-UHFFFAOYSA-N |
Product Overview
4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole (CAS 906520-27-2), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: 2-(3-methoxyphenyl)-4-propan-2-yl-4,5-dihydro-1,3-oxazole.
Chemical Property Profile of 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole
Property Insights of 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole. With a topological polar surface area (TPSA) of 30.8 Ų, 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole 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-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole?
The CAS number of 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole is 906520-27-2.
What is the molecular formula of 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole?
The molecular formula of 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole is C13H17NO2.
What is the molecular weight of 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole?
The molecular weight of 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole is 219.13 g/mol.
Where can I buy 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole?
You can request a quote for 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Isopropyl-2-(3-methoxyphenyl)-4,5-dihydrooxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.