5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-
TL;DR: 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro- (CAS 57831-73-9) is a chemical compound with molecular formula C9H9N5O2 and molecular weight 219.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-3,6,10,13-tetrazatricyclo[8.3.0.02,6]trideca-1(13),2,4,11-tetraene
Also Known As: 5H,6H,7H-DIIMIDAZO(1,2-a;2',1'-c)(1,4)DIAZEPINE, 3-NITRO-, 3-Nitro-5H,6H,7H-diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-Nitro-6,7-dihydro-5H-diimidazo[1,2-a:2',1'-c][1,4]diazepine, 9-nitro-6,7-dihydro-5H-diimidazo[1,3-b:1',3'-e][1,4]diazepine, 3-Nitro-6,7-dihydro-5H-diimidazo[1,2-a:2 ,1 -c][1,4]diazepine
| Molecular Formula | C9H9N5O2 |
|---|---|
| Molecular Weight | 219.08 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.07562 |
| Heavy Atoms | 16 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 57831-73-9 |
|---|---|
| SMILES | C1CN2C=CN=C2C3=NC=C(N3C1)[N+](=O)[O-] |
| InChIKey | XWVVVOXZCVFUSD-UHFFFAOYSA-N |
Product Overview
5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro- (CAS 57831-73-9), with molecular formula C9H9N5O2 and molecular weight 219.08 g/mol. IUPAC: 5-nitro-3,6,10,13-tetrazatricyclo[8.3.0.02,6]trideca-1(13),2,4,11-tetraene.
Chemical Property Profile of 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-
Property Insights of 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-. Following Lipinski's Rule of Five, 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro- has 0 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 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-?
The CAS number of 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro- is 57831-73-9.
What is the molecular formula of 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-?
The molecular formula of 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro- is C9H9N5O2.
What is the molecular weight of 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-?
The molecular weight of 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro- is 219.08 g/mol.
Where can I buy 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-?
You can request a quote for 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 5H,6H,7H-Diimidazo(1,2-a;2',1'-c)(1,4)diazepine, 3-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.