methanone structure](/static/products/956/956368-93-7.png)
[1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone
TL;DR: [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone (CAS 956368-93-7) is a chemical compound with molecular formula C13H18F3N3O2 and molecular weight 305.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-tert-butyl-5-(trifluoromethyl)pyrazol-4-yl]-morpholin-4-ylmethanone
Also Known As: [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone, [1-tert-butyl-5-(trifluoromethyl)pyrazol-4-yl]-morpholin-4-ylmethanone, 8X-5073, [1-tert-butyl-5-(trifluoromethyl)pyrazol-4-yl]-morpholino-methanone, 4-[1-tert-butyl-5-(trifluoromethyl)pyrazole-4-carbonyl]morpholine
| Molecular Formula | C13H18F3N3O2 |
|---|---|
| Molecular Weight | 305.14 g/mol |
| LogP | 2.1293 |
| Topological Polar Surface Area | 47.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 305.1351 |
| Heavy Atoms | 21 |
| Complexity | 525.74426 |
Chemical Identifiers
| CAS Number | 956368-93-7 |
|---|---|
| SMILES | CC(C)(C)N1C(=C(C=N1)C(=O)N2CCOCC2)C(F)(F)F |
Product Overview
[1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone (CAS 956368-93-7), with molecular formula C13H18F3N3O2 and molecular weight 305.14 g/mol. IUPAC: [1-tert-butyl-5-(trifluoromethyl)pyrazol-4-yl]-morpholin-4-ylmethanone.
Chemical Property Profile of [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone
Property Insights of [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone
The XLogP value of 2.1293 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone. With a topological polar surface area (TPSA) of 47.36 Ų, [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone 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
Frequently Asked Questions
What is the CAS number of [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone?
The CAS number of [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone is 956368-93-7.
What is the molecular formula of [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone?
The molecular formula of [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone is C13H18F3N3O2.
What is the molecular weight of [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone?
The molecular weight of [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone is 305.14 g/mol.
Where can I buy [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone?
You can request a quote for [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone?
Yes, KEHONG BIO provides custom synthesis services for [1-(tert-butyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl](morpholino)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.