![1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone structure](/static/products/100/1003552-66-6.png)
1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone
TL;DR: 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone (CAS 1003552-66-6) is a chemical compound with molecular formula C18H20N6O and molecular weight 336.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[6-[4-(dimethylamino)anilino]pyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone
Also Known As: 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone, 1-(1-(6-((4-(dimethylamino)phenyl)amino)pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl)ethanone, 1-[1-[6-[4-(dimethylamino)anilino]pyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone
| Molecular Formula | C18H20N6O |
|---|---|
| Molecular Weight | 336.17 g/mol |
| LogP | 2.98292 |
| Topological Polar Surface Area | 75.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.16986 |
| Heavy Atoms | 25 |
| Complexity | 898.1847 |
Chemical Identifiers
| CAS Number | 1003552-66-6 |
|---|---|
| SMILES | CC1=C(C=NN1C2=NC=NC(=C2)NC3=CC=C(C=C3)N(C)C)C(=O)C |
Product Overview
1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone (CAS 1003552-66-6), with molecular formula C18H20N6O and molecular weight 336.17 g/mol. IUPAC: 1-[1-[6-[4-(dimethylamino)anilino]pyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone.
Chemical Property Profile of 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone
Property Insights of 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone
The XLogP value of 2.98292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone. The TPSA of 75.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone. Following Lipinski's Rule of Five, 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone has 1 hydrogen bond donor(s) and 6 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 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone?
The CAS number of 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone is 1003552-66-6.
What is the molecular formula of 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone?
The molecular formula of 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone is C18H20N6O.
What is the molecular weight of 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone?
The molecular weight of 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone is 336.17 g/mol.
Where can I buy 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone?
You can request a quote for 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-(6-{[4-(dimethylamino)phenyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.