9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one
TL;DR: 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one (CAS 57960-37-9) is a chemical compound with molecular formula C16H10N2O and molecular weight 246.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,5,7,9,11,14,16-octaen-13-one
Also Known As: [?]one|9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one|9H-dibenzimidazoazepin-9-one|9H-Dibenzo[c,f]imidazo[1,2-a]azepin-9-one|2-hydroxy-3-dodecyl-1,4-naphthaquinone|9H-dibenz
| Molecular Formula | C16H10N2O |
|---|---|
| Molecular Weight | 246.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 246.07932 |
| Heavy Atoms | 19 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 57960-37-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N4C2=NC=C4 |
| InChIKey | AYSFVIFYOXIPOH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one (CAS 57960-37-9), with molecular formula C16H10N2O and molecular weight 246.08 g/mol. IUPAC: 2,5-diazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,5,7,9,11,14,16-octaen-13-one.
Chemical Property Profile of 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one
Property Insights of 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one. With a topological polar surface area (TPSA) of 34.9 Ų, 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one has 0 hydrogen bond donor(s) and 2 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 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one?
The CAS number of 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one is 57960-37-9.
What is the molecular formula of 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one?
The molecular formula of 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one is C16H10N2O.
What is the molecular weight of 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one?
The molecular weight of 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one is 246.08 g/mol.
Where can I buy 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one?
You can request a quote for 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one?
Yes, KEHONG BIO provides custom synthesis services for 9H-Dibenzo(c,f)imidazo(1,2-a)azepin-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.