TL;DR: Isocolchiceinamide (CAS 25269-21-0) is a chemical compound with molecular formula C21H24N2O5 and molecular weight 384.16852 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(9-amino-1,2,3-trimethoxy-10-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
Also Known As: Isocolchiceinamide, n-(9-amino-1,2,3-trimethoxy-10-oxo-5,6,7,10-tetrahydrobenzo[a]heptalen-7-yl)acetamide, Acetamide,N-(9-amino-5,6,7,10-tetrahydro-1,2,3-trimethoxy-10-oxobenzo[a]heptalen-7-yl)-,(S)-, Acetamide,6,7,10-tetrahydro-1,2,3-trimethoxy-10-oxobenzo[a]heptalen-7-yl)-, (S)-, N-(9-amino-1,2,3-trimethoxy-10-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
| Molecular Formula | C21H24N2O5 |
| Molecular Weight | 384.16852 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 99.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.16852 Da |
| Heavy Atoms | 28 |
| Complexity | 726.0 |
| SMILES | CC(=O)NC1CCC2=CC(=C(C(=C2C3=C1C=C(C(=O)C=C3)N)OC)OC)OC |
| InChIKey | RUFVXHLYYCFXHF-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isocolchiceinamide. The TPSA of 99.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Isocolchiceinamide. Following Lipinski's Rule of Five, Isocolchiceinamide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Isocolchiceinamide is 25269-21-0.
The molecular formula of Isocolchiceinamide is C21H24N2O5.
The molecular weight of Isocolchiceinamide is 384.16852 g/mol.
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