5,8-Dimethyldibenzo[d,f][1,2]diazocine
TL;DR: 5,8-Dimethyldibenzo[d,f][1,2]diazocine (CAS 131867-99-7) is a chemical compound with molecular formula C16H14N2 and molecular weight 234.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1Z,7Z,11Z)-8,11-dimethyl-9,10-diazatricyclo[10.4.0.02,7]hexadeca-1,3,5,7,9,11,13,15-octaene
Also Known As: 5,8-Dimethyldibenzo[d,f][1,2]diazocine, 5,8-dimethyl-dibenzo(d,f)(1,2)diazocine, (8Z,10Z)-8,11-dimethyl-9,10-diazatricyclo[10.4.0.0^{2,7}]hexadeca-1(12),2,4,6,8,10,13,15-octaene
| Molecular Formula | C16H14N2 |
|---|---|
| Molecular Weight | 234.12 g/mol |
| LogP | 2.69558 |
| Topological Polar Surface Area | 24.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 234.11569 |
| Heavy Atoms | 18 |
| Complexity | 773.65106 |
Chemical Identifiers
| CAS Number | 131867-99-7 |
|---|---|
| SMILES | C/C/1=C\2/C(=C/3\C(=C(/N=N1)\C)\C=CC=C3)/C=CC=C2 |
Product Overview
5,8-Dimethyldibenzo[d,f][1,2]diazocine (CAS 131867-99-7), with molecular formula C16H14N2 and molecular weight 234.12 g/mol. IUPAC: (1Z,7Z,11Z)-8,11-dimethyl-9,10-diazatricyclo[10.4.0.02,7]hexadeca-1,3,5,7,9,11,13,15-octaene.
Chemical Property Profile of 5,8-Dimethyldibenzo[d,f][1,2]diazocine
Property Insights of 5,8-Dimethyldibenzo[d,f][1,2]diazocine
The XLogP value of 2.69558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,8-Dimethyldibenzo[d,f][1,2]diazocine. With a topological polar surface area (TPSA) of 24.72 Ų, 5,8-Dimethyldibenzo[d,f][1,2]diazocine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,8-Dimethyldibenzo[d,f][1,2]diazocine 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 5,8-Dimethyldibenzo[d,f][1,2]diazocine?
The CAS number of 5,8-Dimethyldibenzo[d,f][1,2]diazocine is 131867-99-7.
What is the molecular formula of 5,8-Dimethyldibenzo[d,f][1,2]diazocine?
The molecular formula of 5,8-Dimethyldibenzo[d,f][1,2]diazocine is C16H14N2.
What is the molecular weight of 5,8-Dimethyldibenzo[d,f][1,2]diazocine?
The molecular weight of 5,8-Dimethyldibenzo[d,f][1,2]diazocine is 234.12 g/mol.
Where can I buy 5,8-Dimethyldibenzo[d,f][1,2]diazocine?
You can request a quote for 5,8-Dimethyldibenzo[d,f][1,2]diazocine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,8-Dimethyldibenzo[d,f][1,2]diazocine?
Yes, KEHONG BIO provides custom synthesis services for 5,8-Dimethyldibenzo[d,f][1,2]diazocine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.