10-Benzylthio-10-demethoxy-colchicine
N-(10-benzylsulfanyl-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
Also Known As: 10-Benzylthio-10-demethoxy-colchicine|Colchicine, 10-(benzylthio)-10-demethoxy-|10-(Benzylthio)-10-demethoxycolchicine|4-14-00-00958 (Beilstein Handbook Reference)|Acetamide, N-(5,6,7,9-tetrahydro-1,2,3-trimethoxy-9-oxo-10-((phenylmethyl)thio)benzo(a)heptalen-7-yl)-, (S)-|n-[10-(benzylsulfanyl)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide|Acetamide, N-[5,6,7,9-tetrahydro-1,2,3-trimethoxy-9-oxo-10-[(phenylmethyl)thio]benzo[c]heptalen-7-yl]-, (S)-|N-(10-benzylsulfanyl-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
| Molecular Formula | C28H29NO5S |
|---|---|
| Molecular Weight | 491.17664 g/mol |
| LogP | 5.16 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 491.17664 |
| Heavy Atoms | 35 |
| Complexity | 1292.8 |
Chemical Identifiers
| CAS Number | 76129-12-9 |
|---|---|
| SMILES | CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SCC4=CC=CC=C4)OC)OC)OC |
Product Overview
10-Benzylthio-10-demethoxy-colchicine (CAS 76129-12-9), with molecular formula C28H29NO5S and molecular weight 491.17664 g/mol. IUPAC: N-(10-benzylsulfanyl-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide.
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