TL;DR: 2,4-dimethyl-5-oxo-5H-chromeno[3,4-c]pyridine-1-carbonitrile (CAS 118733-99-6) is a chemical compound with molecular formula C15H10N2O2 and molecular weight 250.07423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dimethyl-5-oxochromeno[3,4-c]pyridine-1-carbonitrile
Also Known As: 2,4-dimethyl-5-oxo-5H-chromeno[3,4-c]pyridine-1-carbonitrile, 2,4-dimethyl-5-oxochromeno[3,4-c]pyridine-1-carbonitrile, 3F-906
| Molecular Formula | C15H10N2O2 |
| Molecular Weight | 250.07423 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 63.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 250.07423 Da |
| Heavy Atoms | 19 |
| Complexity | 427.0 |
| SMILES | CC1=C(C2=C(C(=N1)C)C(=O)OC3=CC=CC=C32)C#N |
| InChIKey | ITIUOCZDNPTFMJ-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-dimethyl-5-oxo-5H-chromeno[3,4-c]pyridine-1-carbonitrile. The TPSA of 63.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-dimethyl-5-oxo-5H-chromeno[3,4-c]pyridine-1-carbonitrile. Following Lipinski's Rule of Five, 2,4-dimethyl-5-oxo-5H-chromeno[3,4-c]pyridine-1-carbonitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,4-dimethyl-5-oxo-5H-chromeno[3,4-c]pyridine-1-carbonitrile is 118733-99-6.
The molecular formula of 2,4-dimethyl-5-oxo-5H-chromeno[3,4-c]pyridine-1-carbonitrile is C15H10N2O2.
The molecular weight of 2,4-dimethyl-5-oxo-5H-chromeno[3,4-c]pyridine-1-carbonitrile is 250.07423 g/mol.
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