TL;DR: Colchicine, N-deacetyl-N-benzoyl- (CAS 63989-75-3) is a chemical compound with molecular formula C27H27NO6 and molecular weight 461.18384 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]benzamide
Also Known As: N-Benzoyl tmca methyl ether, N-Benzoyl-deacetylcolchicine, Colchicine, N-benzoyl-N-deacetyl-, Colchicinic acid, methyl ether, N-Deacetyl-N-benzoylcolchicine
| Molecular Formula | C27H27NO6 |
| Molecular Weight | 461.18384 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 461.18384 Da |
| Heavy Atoms | 34 |
| Complexity | 855.0 |
| SMILES | COC1=CC=C2C(=CC1=O)[C@H](CCC3=CC(=C(C(=C32)OC)OC)OC)NC(=O)C4=CC=CC=C4 |
| InChIKey | XTSSXTWGEJTWBM-FQEVSTJZSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Colchicine, N-deacetyl-N-benzoyl-. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Colchicine, N-deacetyl-N-benzoyl-. Following Lipinski's Rule of Five, Colchicine, N-deacetyl-N-benzoyl- has 1 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 Colchicine, N-deacetyl-N-benzoyl- is 63989-75-3.
The molecular formula of Colchicine, N-deacetyl-N-benzoyl- is C27H27NO6.
The molecular weight of Colchicine, N-deacetyl-N-benzoyl- is 461.18384 g/mol.
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