2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one
TL;DR: 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one (CAS 89242-30-8) is a chemical compound with molecular formula C17H12ClNO2 and molecular weight 297.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-2-(2-chlorophenyl)-4-[(4-methylphenyl)methylidene]-1,3-oxazol-5-one
Also Known As: 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one, A0205/0009169, 5(4H)-Oxazolone, 2-(2-chlorophenyl)-4-[(4-methylphenyl)methylene]-, (4Z)-2-(2-chlorophenyl)-4-[(4-methylphenyl)methylidene]-1,3-oxazol-5-one, (4Z)-2-(2-CHLOROPHENYL)-4-[(4-METHYLPHENYL)METHYLIDENE]-4,5-DIHYDRO-1,3-OXAZOL-5-ONE
| Molecular Formula | C17H12ClNO2 |
|---|---|
| Molecular Weight | 297.06 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.05566 |
| Heavy Atoms | 21 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 89242-30-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C\2/C(=O)OC(=N2)C3=CC=CC=C3Cl |
| InChIKey | NDHVFVOIJJCBNY-GDNBJRDFSA-N |
Product Overview
2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one (CAS 89242-30-8), with molecular formula C17H12ClNO2 and molecular weight 297.06 g/mol. IUPAC: (4Z)-2-(2-chlorophenyl)-4-[(4-methylphenyl)methylidene]-1,3-oxazol-5-one.
Chemical Property Profile of 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one
Property Insights of 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one
The XLogP value of 4.6 indicates that 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one 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-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one?
The CAS number of 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one is 89242-30-8.
What is the molecular formula of 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one?
The molecular formula of 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one is C17H12ClNO2.
What is the molecular weight of 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one?
The molecular weight of 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one is 297.06 g/mol.
Where can I buy 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one?
You can request a quote for 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chlorophenyl)-4-(4-methylbenzylidene)oxazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.