7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one
TL;DR: 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one (CAS 1022681-28-2) is a chemical compound with molecular formula C16H18N2O and molecular weight 254.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one
Also Known As: 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one, 7-METHYL-3-(4-METHYLPHENYL)-1,4,6,7,8-PENTAHYDROCINNOLIN-5-ONE, 7-methyl-3-(p-tolyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one
Technical Specifications
| Molecular Formula | C16H18N2O |
| Molecular Weight | 254.1419 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.1419 Da |
| Heavy Atoms | 19 |
| Complexity | 442.0 |
| SMILES | CC1CC2=C(CC(=NN2)C3=CC=C(C=C3)C)C(=O)C1 |
| InChIKey | IBHZJXUYDYTZQW-UHFFFAOYSA-N |
Chemical Property Profile of 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one
Property Insights of 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one. With a topological polar surface area (TPSA) of 41.5 Ų, 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one?
The CAS number of 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one is 1022681-28-2.
What is the molecular formula of 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one?
The molecular formula of 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one is C16H18N2O.
What is the molecular weight of 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one?
The molecular weight of 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one is 254.1419 g/mol.
Where can I buy 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one?
You can request a quote for 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one?
Yes, CoreyChem provides custom synthesis services for 7-methyl-3-(4-methylphenyl)-4,6,7,8-tetrahydro-1H-cinnolin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.