2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one
TL;DR: 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one (CAS 866020-36-2) is a chemical compound with molecular formula C15H12N2O4 and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one
Also Known As: 2-methyl-7-nitro-6H-dibenzo[b,f][1,4]oxazocin-11(12H)-one, 2-methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one, 14-methyl-5-nitro-2-oxa-11-azatricyclo[10.4.0.0^{4,9}]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-one, 14-methyl-5-nitro-2-oxa-11-azatricyclo[10.4.0.0?,?]hexadeca-1(16),4(9),5,7,12,14-hexaen-10-one, 14-methyl-5-nitro-2-oxa-11-azatricyclo[10.4.0.0?,?]hexadeca-1(16),4,6,8,12,14-hexaen-10-one
| Molecular Formula | C15H12N2O4 |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 3.04792 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 284.0797 |
| Heavy Atoms | 21 |
| Complexity | 755.334 |
Chemical Identifiers
| CAS Number | 866020-36-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OCC3=C(C=CC=C3[N+](=O)[O-])C(=O)N2 |
Product Overview
2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one (CAS 866020-36-2), with molecular formula C15H12N2O4 and molecular weight 284.08 g/mol. IUPAC: 2-methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one.
Chemical Property Profile of 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one
Property Insights of 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one
The XLogP value of 3.04792 indicates that 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one. Following Lipinski's Rule of Five, 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one has 1 hydrogen bond donor(s) and 4 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-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one?
The CAS number of 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one is 866020-36-2.
What is the molecular formula of 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one?
The molecular formula of 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one is C15H12N2O4.
What is the molecular weight of 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one?
The molecular weight of 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one is 284.08 g/mol.
Where can I buy 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one?
You can request a quote for 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-7-nitro-6,12-dihydrobenzo[c][1,6]benzoxazocin-11-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.