1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-
TL;DR: 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)- (CAS 89771-80-2) is a chemical compound with molecular formula C12H16N2 and molecular weight 188.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-4,5-diazatetracyclo[6.2.1.13,6.02,7]dodeca-4,9-diene
Also Known As: 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-, 10,10-Dimethyl-1,4,4a,5,8,8a-hexahydro-1,4:5,8-dimethanophthalazine, 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1.alpha.,4.alpha.,4a.alpha.,5.alpha.,8.alpha.,8a.alpha.)-, 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl-(1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-
| Molecular Formula | C12H16N2 |
|---|---|
| Molecular Weight | 188.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.13135 |
| Heavy Atoms | 14 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 89771-80-2 |
|---|---|
| SMILES | CC1(C2C3C4CC(C3C1N=N2)C=C4)C |
| InChIKey | DOVAPCUYIHVHJZ-UHFFFAOYSA-N |
Product Overview
1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)- (CAS 89771-80-2), with molecular formula C12H16N2 and molecular weight 188.13 g/mol. IUPAC: 12,12-dimethyl-4,5-diazatetracyclo[6.2.1.13,6.02,7]dodeca-4,9-diene.
Chemical Property Profile of 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-
Property Insights of 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-. With a topological polar surface area (TPSA) of 24.7 Ų, 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)- 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 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-?
The CAS number of 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)- is 89771-80-2.
What is the molecular formula of 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-?
The molecular formula of 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)- is C12H16N2.
What is the molecular weight of 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-?
The molecular weight of 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)- is 188.13 g/mol.
Where can I buy 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-?
You can request a quote for 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)-?
Yes, KEHONG BIO provides custom synthesis services for 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl- (1alpha,4alpha,4aalpha,5alpha,8alpha,8aalpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.