![2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole structure](/static/products/1763/176324-85-9.webp)
2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole
TL;DR: 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole (CAS 176324-85-9) is a chemical compound with molecular formula C12H14BrNO and molecular weight 267.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole
Also Known As: Bilastine Impurity 42, starbld0011453, 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole, 2-(4-Bromobenzyl)-4,4-dimethyl-4,5-dihydrooxazole, 2-[(4-Bromophenyl)methyl]-4,5-dihydro-4,4-dimethyloxazole
| Molecular Formula | C12H14BrNO |
|---|---|
| Molecular Weight | 267.03 g/mol |
| LogP | 3.1989 |
| Topological Polar Surface Area | 21.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.02588 |
| Heavy Atoms | 15 |
| Complexity | 381.11353 |
Chemical Identifiers
| CAS Number | 176324-85-9 |
|---|---|
| SMILES | CC1(COC(=N1)CC2=CC=C(C=C2)Br)C |
Product Overview
2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole (CAS 176324-85-9), with molecular formula C12H14BrNO and molecular weight 267.03 g/mol. IUPAC: 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole.
Chemical Property Profile of 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole
Property Insights of 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole
The XLogP value of 3.1989 indicates that 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.59 Ų, 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole has 0 hydrogen bond donor(s) and 2 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-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole?
The CAS number of 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole is 176324-85-9.
What is the molecular formula of 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole?
The molecular formula of 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole is C12H14BrNO.
What is the molecular weight of 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole?
The molecular weight of 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole is 267.03 g/mol.
Where can I buy 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole?
You can request a quote for 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-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 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-bromophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.