2-Benzoyl-5-chloro-1,3-benzoxazole
TL;DR: 2-Benzoyl-5-chloro-1,3-benzoxazole (CAS 32729-66-1) is a chemical compound with molecular formula C14H8ClNO2 and molecular weight 257.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloro-1,3-benzoxazol-2-yl)-phenylmethanone
Also Known As: 2-Benzoyl-5-chlorobenzoxazole, 2-benzoyl-5-chloro-1,3-benzoxazole, (5-Chlorobenzo[d]oxazol-2-yl)(phenyl)methanone, Methanone, (5-chloro-2-benzoxazolyl)phenyl-, J3.470.886J
| Molecular Formula | C14H8ClNO2 |
|---|---|
| Molecular Weight | 257.02 g/mol |
| LogP | 3.7122 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.02435 |
| Heavy Atoms | 18 |
| Complexity | 718.997 |
Chemical Identifiers
| CAS Number | 32729-66-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=NC3=C(O2)C=CC(=C3)Cl |
Product Overview
2-Benzoyl-5-chloro-1,3-benzoxazole (CAS 32729-66-1), with molecular formula C14H8ClNO2 and molecular weight 257.02 g/mol. IUPAC: (5-chloro-1,3-benzoxazol-2-yl)-phenylmethanone.
Chemical Property Profile of 2-Benzoyl-5-chloro-1,3-benzoxazole
Property Insights of 2-Benzoyl-5-chloro-1,3-benzoxazole
The XLogP value of 3.7122 indicates that 2-Benzoyl-5-chloro-1,3-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 2-Benzoyl-5-chloro-1,3-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzoyl-5-chloro-1,3-benzoxazole 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 2-Benzoyl-5-chloro-1,3-benzoxazole?
The CAS number of 2-Benzoyl-5-chloro-1,3-benzoxazole is 32729-66-1.
What is the molecular formula of 2-Benzoyl-5-chloro-1,3-benzoxazole?
The molecular formula of 2-Benzoyl-5-chloro-1,3-benzoxazole is C14H8ClNO2.
What is the molecular weight of 2-Benzoyl-5-chloro-1,3-benzoxazole?
The molecular weight of 2-Benzoyl-5-chloro-1,3-benzoxazole is 257.02 g/mol.
Where can I buy 2-Benzoyl-5-chloro-1,3-benzoxazole?
You can request a quote for 2-Benzoyl-5-chloro-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-Benzoyl-5-chloro-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzoyl-5-chloro-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.