![N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide structure](/static/products/100/1005172-19-9.png)
N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide
TL;DR: N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide (CAS 1005172-19-9) is a chemical compound with molecular formula C19H14F6N2O3 and molecular weight 432.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide, N-((1,3-dioxo-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindol-2(3H)-yl)methyl)-2,2,2-trifluoro-N-(3-(trifluoromethyl)phenyl)acetamide
| Molecular Formula | C19H14F6N2O3 |
|---|---|
| Molecular Weight | 432.09 g/mol |
| LogP | 3.3653 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 432.09085 |
| Heavy Atoms | 30 |
| Complexity | 924.3235 |
Chemical Identifiers
| CAS Number | 1005172-19-9 |
|---|---|
| SMILES | C1C2C=CC1C3C2C(=O)N(C3=O)CN(C4=CC=CC(=C4)C(F)(F)F)C(=O)C(F)(F)F |
Product Overview
N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide (CAS 1005172-19-9), with molecular formula C19H14F6N2O3 and molecular weight 432.09 g/mol. IUPAC: N-[(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide
Property Insights of N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide
The XLogP value of 3.3653 indicates that N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide 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 N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide?
The CAS number of N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide is 1005172-19-9.
What is the molecular formula of N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide?
The molecular formula of N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide is C19H14F6N2O3.
What is the molecular weight of N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide?
The molecular weight of N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide is 432.09 g/mol.
Where can I buy N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide?
You can request a quote for N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.