TL;DR: N-Methylcolchifoline (CAS 86436-33-1) is a chemical compound with molecular formula C23H27NO7 and molecular weight 429.17874 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-N-methyl-N-(1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
Also Known As: N-Methylcolchifoline, N-Hydroxyacetyldemecolcine, Democolcine, N-hydroxyacetyl, Acetamide, 2-hydroxy-N-methyl-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo(a)heptalen-7-yl)-, 2-hydroxy-n-methyl-n-(1,2,3,10-tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide
| Molecular Formula | C23H27NO7 |
| Molecular Weight | 429.17874 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 94.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.17874 Da |
| Heavy Atoms | 31 |
| Complexity | 787.0 |
| SMILES | CN(C1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC)C(=O)CO |
| InChIKey | IMFKEFSPNMKGLP-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methylcolchifoline. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methylcolchifoline. Following Lipinski's Rule of Five, N-Methylcolchifoline has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-Methylcolchifoline is 86436-33-1.
The molecular formula of N-Methylcolchifoline is C23H27NO7.
The molecular weight of N-Methylcolchifoline is 429.17874 g/mol.
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