(e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one
TL;DR: (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one (CAS 154821-60-0) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(dimethylaminomethylidene)-2-(4-methylphenyl)-1,3-oxazol-5-one
Also Known As: 4-(dimethylaminomethylene)-2-(p-tolyl)oxazol-5-one, (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one, 4-(dimethylaminomethylidene)-2-(4-methylphenyl)-1,3-oxazol-5-one, (4E)-4-[(dimethylamino)methylidene]-2-(4-methylphenyl)-4,5-dihydro-1,3-oxazol-5-one, 4-[(E)-(dimethylamino)methylidene]-2-(4-methylphenyl)-1,3-oxazol-5(4H)-one
Technical Specifications
| Molecular Formula | C13H14N2O2 |
| Molecular Weight | 230.10553 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.10553 Da |
| Heavy Atoms | 17 |
| Complexity | 364.0 |
| SMILES | CC1=CC=C(C=C1)C2=NC(=CN(C)C)C(=O)O2 |
| InChIKey | CFEDQSBXLMNVQP-UHFFFAOYSA-N |
Chemical Property Profile of (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one
Property Insights of (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one. With a topological polar surface area (TPSA) of 41.9 Ų, (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one?
The CAS number of (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one is 154821-60-0.
What is the molecular formula of (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one?
The molecular formula of (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one is C13H14N2O2.
What is the molecular weight of (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one?
The molecular weight of (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one is 230.10553 g/mol.
Where can I buy (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one?
You can request a quote for (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one?
Yes, CoreyChem provides custom synthesis services for (e)-4-((Dimethylamino)methylene)-2-(p-tolyl)oxazol-5(4h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.