![3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone structure](/static/products/5151/515120-44-2.webp)
3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone
TL;DR: 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone (CAS 515120-44-2) is a chemical compound with molecular formula C21H23BrN2O2 and molecular weight 414.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone
Also Known As: 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone, {3-[(4-bromophenoxy)methyl]phenyl}(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methanone, [3-[(4-bromophenoxy)methyl]phenyl]-(1,4-diazabicyclo[4.3.0]non-4-yl)methanone, 4-bromophenyl 3-(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-ylcarbonyl)benzyl ether, {3-[(4-BROMOPHENOXY)METHYL]PHENYL}[HEXAHYDROPYRROLO[1,2-A]PYRAZIN-2(1H)-YL]METHANONE
| Molecular Formula | C21H23BrN2O2 |
|---|---|
| Molecular Weight | 414.09 g/mol |
| LogP | 3.9483 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 414.0943 |
| Heavy Atoms | 26 |
| Complexity | 777.83545 |
Chemical Identifiers
| CAS Number | 515120-44-2 |
|---|---|
| SMILES | C1CC2CN(CCN2C1)C(=O)C3=CC=CC(=C3)COC4=CC=C(C=C4)Br |
Product Overview
3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone (CAS 515120-44-2), with molecular formula C21H23BrN2O2 and molecular weight 414.09 g/mol. IUPAC: 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone.
Chemical Property Profile of 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone
Property Insights of 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone
The XLogP value of 3.9483 indicates that 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.78 Ų, 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]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 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone?
The CAS number of 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone is 515120-44-2.
What is the molecular formula of 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone?
The molecular formula of 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone is C21H23BrN2O2.
What is the molecular weight of 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone?
The molecular weight of 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone is 414.09 g/mol.
Where can I buy 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone?
You can request a quote for 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone?
Yes, KEHONG BIO provides custom synthesis services for 3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[3-[(4-bromophenoxy)methyl]phenyl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.