![(1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one structure](/static/products/121/1212305-95-7.webp)
(1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
TL;DR: (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one (CAS 1212305-95-7) is a chemical compound with molecular formula C13H13Cl3N2O2 and molecular weight 334.00427 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,9S)-11-(2,2,2-trichloroacetyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
Also Known As: (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Technical Specifications
| Molecular Formula | C13H13Cl3N2O2 |
| Molecular Weight | 334.00427 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 334.00427 Da |
| Heavy Atoms | 20 |
| Complexity | 524.0 |
| SMILES | C1[C@H]2CN(C[C@H]1C3=CC=CC(=O)N3C2)C(=O)C(Cl)(Cl)Cl |
| InChIKey | SGMKHRGQLWSOLT-IUCAKERBSA-N |
Chemical Property Profile of (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Property Insights of (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one. With a topological polar surface area (TPSA) of 40.6 Ų, (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one 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
What is the CAS number of (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
The CAS number of (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one is 1212305-95-7.
What is the molecular formula of (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
The molecular formula of (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one is C13H13Cl3N2O2.
What is the molecular weight of (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
The molecular weight of (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one is 334.00427 g/mol.
Where can I buy (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
You can request a quote for (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
Yes, CoreyChem provides custom synthesis services for (1S,5S)-3-(trichloroacetyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.