4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline
TL;DR: 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline (CAS 1020713-23-8) is a chemical compound with molecular formula C12H15N3O and molecular weight 217.1215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(3,5-dimethylpyrazol-1-yl)-3-methoxyaniline
Also Known As: 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline, starbld0020924, 4-(3,5-dimethylpyrazol-1-yl)-3-methoxyaniline, 4-(3,5-dimethylpyrazol-1-yl)-3-methoxy-aniline, BB 0243374
Technical Specifications
| Molecular Formula | C12H15N3O |
| Molecular Weight | 217.1215 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 53.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.1215 Da |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
| SMILES | CC1=CC(=NN1C2=C(C=C(C=C2)N)OC)C |
| InChIKey | WBRALSDLFWUYFP-UHFFFAOYSA-N |
Chemical Property Profile of 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline
Property Insights of 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline. With a topological polar surface area (TPSA) of 53.1 Ų, 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline?
The CAS number of 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline is 1020713-23-8.
What is the molecular formula of 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline?
The molecular formula of 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline is C12H15N3O.
What is the molecular weight of 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline?
The molecular weight of 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline is 217.1215 g/mol.
Where can I buy 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline?
You can request a quote for 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline?
Yes, CoreyChem provides custom synthesis services for 4-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.