3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide
TL;DR: 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide (CAS 956607-58-2) is a chemical compound with molecular formula C12H18ClN3O and molecular weight 255.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide
Also Known As: 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide, (E)-3-(5-chloro-1,3-dimethyl-1H-pyrazol-4-yl)-N,N-diethyl-2-propenamide
| Molecular Formula | C12H18ClN3O |
|---|---|
| Molecular Weight | 255.11 g/mol |
| LogP | 2.26352 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.11385 |
| Heavy Atoms | 17 |
| Complexity | 433.20428 |
Chemical Identifiers
| CAS Number | 956607-58-2 |
|---|---|
| SMILES | CCN(CC)C(=O)C=CC1=C(N(N=C1C)C)Cl |
Product Overview
3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide (CAS 956607-58-2), with molecular formula C12H18ClN3O and molecular weight 255.11 g/mol. IUPAC: 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide.
Chemical Property Profile of 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide
Property Insights of 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide
The XLogP value of 2.26352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide. With a topological polar surface area (TPSA) of 38.13 Ų, 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide has 0 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-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide?
The CAS number of 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide is 956607-58-2.
What is the molecular formula of 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide?
The molecular formula of 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide is C12H18ClN3O.
What is the molecular weight of 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide?
The molecular weight of 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide is 255.11 g/mol.
Where can I buy 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide?
You can request a quote for 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-N,N-diethylprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.