4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one
TL;DR: 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one (CAS 1787-23-1) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-(dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one
Also Known As: 4-[4-(dimethylamino)benzylidene]-2-methyl-1,3-oxazol-5(4H)-one, 4-(4-(Dimethylamino)benzylidene)-2-methyloxazol-5(4H)-one, 4-[(4-dimethylaminophenyl)methylidene]-2-methyl-1,3-oxazol-5-one, 4-{[4-(DIMETHYLAMINO)PHENYL]METHYLIDENE}-2-METHYL-1,3-OXAZOL-5-ONE
| Molecular Formula | C13H14N2O2 |
|---|---|
| Molecular Weight | 230.11 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.10553 |
| Heavy Atoms | 17 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 1787-23-1 |
|---|---|
| SMILES | CC1=NC(=CC2=CC=C(C=C2)N(C)C)C(=O)O1 |
| InChIKey | UZJOKNWPCVCPLB-UHFFFAOYSA-N |
Product Overview
4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one (CAS 1787-23-1), with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol. IUPAC: 4-[[4-(dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one.
Chemical Property Profile of 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one
Property Insights of 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one. With a topological polar surface area (TPSA) of 41.9 Ų, 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-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
Frequently Asked Questions
What is the CAS number of 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one?
The CAS number of 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one is 1787-23-1.
What is the molecular formula of 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one?
The molecular formula of 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one is C13H14N2O2.
What is the molecular weight of 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one?
The molecular weight of 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one is 230.11 g/mol.
Where can I buy 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one?
You can request a quote for 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[[4-(Dimethylamino)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.