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5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
TL;DR: 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one (CAS 154953-56-7) is a chemical compound with molecular formula C17H13N3O and molecular weight 275.10587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-benzyl-3H-pyridazino[4,5-b]indol-4-one
Also Known As: 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one, 5-benzyl-3H-pyridazino[4,5-b]indol-4-one
Technical Specifications
| Molecular Formula | C17H13N3O |
| Molecular Weight | 275.10587 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 46.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.10587 Da |
| Heavy Atoms | 21 |
| Complexity | 430.0 |
| SMILES | C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2C(=O)NN=C4 |
| InChIKey | BXZMDFCSGHUUQF-UHFFFAOYSA-N |
Chemical Property Profile of 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Property Insights of 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one. With a topological polar surface area (TPSA) of 46.4 Ų, 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one?
The CAS number of 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one is 154953-56-7.
What is the molecular formula of 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one?
The molecular formula of 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one is C17H13N3O.
What is the molecular weight of 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one?
The molecular weight of 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one is 275.10587 g/mol.
Where can I buy 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one?
You can request a quote for 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one?
Yes, CoreyChem provides custom synthesis services for 5-benzyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.