Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-
TL;DR: Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro- (CAS 21636-37-3) is a chemical compound with molecular formula C18H18N4O3 and molecular weight 338.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methylpiperazin-1-yl)-8-nitrobenzo[b][1,4]benzoxazepine
Also Known As: 11-(4-Methylpiperazino)-2-nitrodibenzoxazepine, DIBENZ(b,f)(1,4)OXAZEPINE, 11-(4-METHYL-1-PIPERAZINYL)-2-NITRO-, 11-(4-Methyl-1-piperazinyl)-2-nitrodibenz(b,f)(1,4)oxazepine, 6-(4-methylpiperazin-1-yl)-8-nitrobenzo[b][1,4]benzoxazepine, 11-(4-methylpiperazin-1-yl)-2-nitrodibenzo[b,f][1,4]oxazepine
| Molecular Formula | C18H18N4O3 |
|---|---|
| Molecular Weight | 338.14 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 338.13788 |
| Heavy Atoms | 25 |
| Complexity | 527.0 |
Chemical Identifiers
| CAS Number | 21636-37-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)[N+](=O)[O-] |
| InChIKey | MTQQTMPILLUUSQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro- (CAS 21636-37-3), with molecular formula C18H18N4O3 and molecular weight 338.14 g/mol. IUPAC: 6-(4-methylpiperazin-1-yl)-8-nitrobenzo[b][1,4]benzoxazepine.
Chemical Property Profile of Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-
Property Insights of Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-. Following Lipinski's Rule of Five, Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro- has 0 hydrogen bond donor(s) and 5 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 Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-?
The CAS number of Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro- is 21636-37-3.
What is the molecular formula of Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-?
The molecular formula of Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro- is C18H18N4O3.
What is the molecular weight of Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-?
The molecular weight of Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro- is 338.14 g/mol.
Where can I buy Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-?
You can request a quote for Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Dibenz(b,f)(1,4)oxazepine, 11-(4-methyl-1-piperazinyl)-2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.