2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole
TL;DR: 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole (CAS 77293-97-1) is a chemical compound with molecular formula C21H20ClN3O and molecular weight 365.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-(3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl)methanone
Also Known As: 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-Octahydro-2-(4-chlorobenzoyl)pyrazino(1',2':1,6)pyrido(3,4-b)indole, Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(4-chlorobenzoyl)-, (4-Chlorophenyl)(3,4,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl)methanone, BRN 4564560
| Molecular Formula | C21H20ClN3O |
|---|---|
| Molecular Weight | 365.13 g/mol |
| LogP | 3.704 |
| Topological Polar Surface Area | 39.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 365.1295 |
| Heavy Atoms | 26 |
| Complexity | 978.5898 |
Chemical Identifiers
| CAS Number | 77293-97-1 |
|---|---|
| SMILES | C1CN2CC3=C(CC2CN1C(=O)C4=CC=C(C=C4)Cl)C5=CC=CC=C5N3 |
Product Overview
2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole (CAS 77293-97-1), with molecular formula C21H20ClN3O and molecular weight 365.13 g/mol. IUPAC: (4-chlorophenyl)-(3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl)methanone.
Chemical Property Profile of 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole
Property Insights of 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole
The XLogP value of 3.704 indicates that 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.34 Ų, 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole has 1 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 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole?
The CAS number of 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole is 77293-97-1.
What is the molecular formula of 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole?
The molecular formula of 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole is C21H20ClN3O.
What is the molecular weight of 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole?
The molecular weight of 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole is 365.13 g/mol.
Where can I buy 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole?
You can request a quote for 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole?
Yes, KEHONG BIO provides custom synthesis services for 2-p-Chlorobenzoyl-1,2,3,4,6,7,12,12a-octahydropyrazino(2',1':6,1)pyrido(3,4-b)indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.