![3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one structure](/static/products/116/116918-95-7.webp)
3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one
TL;DR: 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one (CAS 116918-95-7) is a chemical compound with molecular formula C17H19NO2 and molecular weight 269.14157 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-5-oxa-1-azatetracyclo[8.8.0.02,7.011,16]octadeca-2(7),11,13,15-tetraen-6-one
Also Known As: 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one, 4-Methyl -5-oxa-1-azatetracyclo[8.8.0.0{2,7}.0{11,16}]octadeca-2(7),11(16),12,14-tetraen-6-one
Technical Specifications
| Molecular Formula | C17H19NO2 |
| Molecular Weight | 269.14157 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 269.14157 Da |
| Heavy Atoms | 20 |
| Complexity | 456.0 |
| SMILES | CC1CC2=C(CCC3N2CCC4=CC=CC=C34)C(=O)O1 |
| InChIKey | HQLGGOMFPAXSIW-UHFFFAOYSA-N |
Chemical Property Profile of 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one
Property Insights of 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one. With a topological polar surface area (TPSA) of 29.5 Ų, 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one has 0 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 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one?
The CAS number of 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one is 116918-95-7.
What is the molecular formula of 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one?
The molecular formula of 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one is C17H19NO2.
What is the molecular weight of 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one?
The molecular weight of 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one is 269.14157 g/mol.
Where can I buy 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one?
You can request a quote for 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one?
Yes, CoreyChem provides custom synthesis services for 3-methyl-3,4,6,7,12,13-hexahydropyrano[3',4':5,6]pyrido[2,1-a]isoquinolin-1(11bH)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.