2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6
TL;DR: 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6 (CAS 54535-45-4) is a chemical compound with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethyl-3,8-diazatetracyclo[8.8.0.03,8.012,17]octadeca-1(18),5,10,12,14,16-hexaene-2,9-dione
Also Known As: 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6, 2,3-Dimethyl-1,4-dihydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione, 5,6-Dimethyl-3,8-diazatetracyclo[8.8.0.03,8.012,17]octadeca-1(18),5,10,12,14,16-hexaene-2,9-dione
| Molecular Formula | C18H16N2O2 |
|---|---|
| Molecular Weight | 292.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 292.1212 |
| Heavy Atoms | 22 |
| Complexity | 505.0 |
Chemical Identifiers
| CAS Number | 54535-45-4 |
|---|---|
| SMILES | CC1=C(CN2C(=O)C3=CC4=CC=CC=C4C=C3C(=O)N2C1)C |
| InChIKey | WKSSCXLQAZXLNJ-UHFFFAOYSA-N |
Product Overview
2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6 (CAS 54535-45-4), with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol. IUPAC: 5,6-dimethyl-3,8-diazatetracyclo[8.8.0.03,8.012,17]octadeca-1(18),5,10,12,14,16-hexaene-2,9-dione.
Chemical Property Profile of 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6
Property Insights of 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6. With a topological polar surface area (TPSA) of 40.6 Ų, 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6 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 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6?
The CAS number of 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6 is 54535-45-4.
What is the molecular formula of 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6?
The molecular formula of 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6 is C18H16N2O2.
What is the molecular weight of 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6?
The molecular weight of 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6 is 292.12 g/mol.
Where can I buy 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6?
You can request a quote for 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6?
Yes, KEHONG BIO provides custom synthesis services for 2,3-dimethyl-1,4,6,13-tetrahydrobenzopyridazinophthalazine-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.