![3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium structure](/static/products/735/735242-96-3.png)
3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium
TL;DR: 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium (CAS 735242-96-3) is a chemical compound with molecular formula C13H15N2O+ and molecular weight 215.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-2-(3,4-dimethyl-1,3-oxazol-3-ium-2-yl)ethenyl]aniline
Also Known As: 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium, Oxazolium, 3,4-dimethyl-2-[2-(phenylamino)ethenyl]-, 3,4-Dimethyl-2-[(1E)-2-(phenylamino)ethenyl]oxazolium, N-[(E)-2-(3,4-dimethyl-1,3-oxazol-2-yl)ethenyl]aniline, N-[2-(3,4-dimethyl-1,3-oxazol-3-ium-2-yl)ethenyl]aniline
| Molecular Formula | C13H15N2O+ |
|---|---|
| Molecular Weight | 215.12 g/mol |
| LogP | 2.49532 |
| Topological Polar Surface Area | 29.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.11844 |
| Heavy Atoms | 16 |
| Complexity | 485.88864 |
Chemical Identifiers
| CAS Number | 735242-96-3 |
|---|---|
| SMILES | CC1=COC(=[N+]1C)/C=C/NC2=CC=CC=C2 |
Product Overview
3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium (CAS 735242-96-3), with molecular formula C13H15N2O+ and molecular weight 215.12 g/mol. IUPAC: N-[(E)-2-(3,4-dimethyl-1,3-oxazol-3-ium-2-yl)ethenyl]aniline.
Chemical Property Profile of 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium
Property Insights of 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium
The XLogP value of 2.49532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium. With a topological polar surface area (TPSA) of 29.05 Ų, 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium has 1 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 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium?
The CAS number of 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium is 735242-96-3.
What is the molecular formula of 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium?
The molecular formula of 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium is C13H15N2O+.
What is the molecular weight of 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium?
The molecular weight of 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium is 215.12 g/mol.
Where can I buy 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium?
You can request a quote for 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dimethyl-2-[2-(phenylamino)ethenyl]oxazolium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.