N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline
TL;DR: N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline (CAS 303985-47-9) is a chemical compound with molecular formula C13H16N2O2 and molecular weight 232.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline
Also Known As: N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline, 11L-612S, N-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-methoxyaniline, N-[(dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline, 4-Isoxazolemethanamine, N-(4-methoxyphenyl)-3,5-dimethyl-
| Molecular Formula | C13H16N2O2 |
|---|---|
| Molecular Weight | 232.12 g/mol |
| LogP | 2.91214 |
| Topological Polar Surface Area | 47.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.12119 |
| Heavy Atoms | 17 |
| Complexity | 469.1206 |
Chemical Identifiers
| CAS Number | 303985-47-9 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)CNC2=CC=C(C=C2)OC |
Product Overview
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline (CAS 303985-47-9), with molecular formula C13H16N2O2 and molecular weight 232.12 g/mol. IUPAC: N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline.
Chemical Property Profile of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline
Property Insights of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline
The XLogP value of 2.91214 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline. With a topological polar surface area (TPSA) of 47.29 Ų, N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline has 1 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 N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline?
The CAS number of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline is 303985-47-9.
What is the molecular formula of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline?
The molecular formula of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline is C13H16N2O2.
What is the molecular weight of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline?
The molecular weight of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline is 232.12 g/mol.
Where can I buy N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline?
You can request a quote for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.