1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin
TL;DR: 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin (CAS 75017-83-3) is a chemical compound with molecular formula C26H26ClN3 and molecular weight 415.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-chloro-7-phenyl-3-(2-phenylethyl)-2,4,4a,5-tetrahydro-1H-pyrazino[1,2-a][1,4]benzodiazepine
Also Known As: 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin, 9-Chloro-3-phenethyl-7-phenyl-1,2,3,4,4a,5-hexahydropyrazino(1,2-a)(1,4)benzodiazepine 2HCl, Pyrazino(1,2-a)(1,4)benzodiazepine, 1,2,3,4,4a,5-hexahydro-9-chloro-3-(2-phenylethyl)-7-phenyl-, 9-chloro-3-phenethyl-7-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[1,2-a][1,4]benzodiazepine, 9-Chloro-7-phenyl-3-(2-phenylethyl)-1,2,3,4,4a,5-hexahydropyrazino[1,2-a][1,4]benzodiazepine
| Molecular Formula | C26H26ClN3 |
|---|---|
| Molecular Weight | 415.18 g/mol |
| LogP | 4.9243 |
| Topological Polar Surface Area | 18.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.18152 |
| Heavy Atoms | 30 |
| Complexity | 1032.659 |
Chemical Identifiers
| CAS Number | 75017-83-3 |
|---|---|
| SMILES | C1CN2C(CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4)CN1CCC5=CC=CC=C5 |
Product Overview
1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin (CAS 75017-83-3), with molecular formula C26H26ClN3 and molecular weight 415.18 g/mol. IUPAC: 9-chloro-7-phenyl-3-(2-phenylethyl)-2,4,4a,5-tetrahydro-1H-pyrazino[1,2-a][1,4]benzodiazepine.
Chemical Property Profile of 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin
Property Insights of 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin
The XLogP value of 4.9243 indicates that 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.84 Ų, 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin 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 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin?
The CAS number of 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin is 75017-83-3.
What is the molecular formula of 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin?
The molecular formula of 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin is C26H26ClN3.
What is the molecular weight of 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin?
The molecular weight of 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin is 415.18 g/mol.
Where can I buy 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin?
You can request a quote for 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4,4a,5-Hexahydro-9-chlor-3-phenaethyl-7-phenyl-pyrazino(1,2-a)(1,4)benzodiazepin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.