![1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one structure](/static/products/3753/375356-51-7.webp)
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one
TL;DR: 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one (CAS 375356-51-7) is a chemical compound with molecular formula C14H13F13N2O and molecular weight 472.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one
Also Known As: 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one, 2-(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoyl)octahydropyrrolo[1,2-a]pyrazine, 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-1-(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)heptan-1-one
| Molecular Formula | C14H13F13N2O |
|---|---|
| Molecular Weight | 472.08 g/mol |
| LogP | 4.0318 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 472.08203 |
| Heavy Atoms | 30 |
| Complexity | 675.23773 |
Chemical Identifiers
| CAS Number | 375356-51-7 |
|---|---|
| SMILES | C1CC2CN(CCN2C1)C(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
Product Overview
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one (CAS 375356-51-7), with molecular formula C14H13F13N2O and molecular weight 472.08 g/mol. IUPAC: 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one.
Chemical Property Profile of 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one
Property Insights of 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one
The XLogP value of 4.0318 indicates that 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-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
Frequently Asked Questions
What is the CAS number of 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one?
The CAS number of 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one is 375356-51-7.
What is the molecular formula of 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one?
The molecular formula of 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one is C14H13F13N2O.
What is the molecular weight of 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one?
The molecular weight of 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one is 472.08 g/mol.
Where can I buy 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one?
You can request a quote for 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.