1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one
TL;DR: 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one (CAS 1001500-64-6) is a chemical compound with molecular formula C10H14BrN3O and molecular weight 271.032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one
Also Known As: 1-(4-Bromo-1-ethyl-1H-pyrazol-3-yl)-3-dimethylaminopropenone, 3-(4-Bromo-1-ethyl-1H-pyrazol-3-yl)-N,N-dimethylacrylamide, 1-(4-bromo-1-ethyl-pyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one, (2E)-1-(4-BROMO-1-ETHYLPYRAZOL-3-YL)-3-(DIMETHYLAMINO)PROP-2-EN-1-ONE, (2Z)-1-(4-bromo-1-ethyl-1H-pyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one
Technical Specifications
| Molecular Formula | C10H14BrN3O |
| Molecular Weight | 271.032 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.032 Da |
| Heavy Atoms | 15 |
| Complexity | 255.0 |
| SMILES | CCN1C=C(C(=N1)C(=O)C=CN(C)C)Br |
| InChIKey | VYTSHNXQERRPRH-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one
Property Insights of 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one. With a topological polar surface area (TPSA) of 38.1 Ų, 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one has 0 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 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one?
The CAS number of 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one is 1001500-64-6.
What is the molecular formula of 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one?
The molecular formula of 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one is C10H14BrN3O.
What is the molecular weight of 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one?
The molecular weight of 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one is 271.032 g/mol.
Where can I buy 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one?
You can request a quote for 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one?
Yes, CoreyChem provides custom synthesis services for 1-(4-Bromo-1-ethylpyrazol-3-yl)-3-(dimethylamino)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.