11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine
TL;DR: 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine (CAS 1977-07-7) is a chemical compound with molecular formula C18H20N4 and molecular weight 292.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methylpiperazin-1-yl)-11H-benzo[b][1,4]benzodiazepine
Also Known As: Deschloroclozapine, Dechloroclozapine, Dopamine serotonin antagonist-1, 11-(4-Methylpiperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepine, Deschloroclozapine (DCZ)
| Molecular Formula | C18H20N4 |
|---|---|
| Molecular Weight | 292.17 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 30.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 292.1688 |
| Heavy Atoms | 22 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 1977-07-7 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC3=CC=CC=C3NC4=CC=CC=C42 |
| InChIKey | VQHITFFJBFOMBG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine (CAS 1977-07-7), with molecular formula C18H20N4 and molecular weight 292.17 g/mol. IUPAC: 6-(4-methylpiperazin-1-yl)-11H-benzo[b][1,4]benzodiazepine.
Chemical Property Profile of 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine
Property Insights of 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine. With a topological polar surface area (TPSA) of 30.9 Ų, 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine has 1 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 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine?
The CAS number of 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine is 1977-07-7.
What is the molecular formula of 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine?
The molecular formula of 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine is C18H20N4.
What is the molecular weight of 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine?
The molecular weight of 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine is 292.17 g/mol.
Where can I buy 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine?
You can request a quote for 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine?
Yes, KEHONG BIO provides custom synthesis services for 11-(4-Methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.