A 80b
TL;DR: A 80b (CAS 135561-94-3) is a chemical compound with molecular formula C16H17N7 and molecular weight 307.15454 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(3,5-dimethylpyrazol-1-yl)-5H-pyridazino[4,5-b]indol-1-yl]-2-methylhydrazine
Also Known As: A 80b, A-80b, 1-[4-(3,5-dimethylpyrazol-1-yl)-5H-pyridazino[4,5-b]indol-1-yl]-2-methylhydrazine, 1H-Pyridazino(4,5-b)indol-1-one, 4-(3,5-dimethyl-1H-pyrazol-1-yl)-2,5-dihydro-, methylhydrazone, 1-Methylhydrazin-4-(3,5-dimethyl-1-pyrazolyl)pyridazino(4,5-b)indole
Technical Specifications
| Molecular Formula | C16H17N7 |
| Molecular Weight | 307.15454 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 83.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.15454 Da |
| Heavy Atoms | 23 |
| Complexity | 419.0 |
| SMILES | CC1=CC(=NN1C2=NN=C(C3=C2NC4=CC=CC=C43)NNC)C |
| InChIKey | LZAUTKZCXBBSMB-UHFFFAOYSA-N |
Chemical Property Profile of A 80b
Property Insights of A 80b
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A 80b. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for A 80b. Following Lipinski's Rule of Five, A 80b has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of A 80b?
The CAS number of A 80b is 135561-94-3.
What is the molecular formula of A 80b?
The molecular formula of A 80b is C16H17N7.
What is the molecular weight of A 80b?
The molecular weight of A 80b is 307.15454 g/mol.
Where can I buy A 80b?
You can request a quote for A 80b directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for A 80b?
Yes, CoreyChem provides custom synthesis services for A 80b and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.