TL;DR: Telocinobufagin (CAS 50262-48-1) is a chemical compound with molecular formula C24H34O5 and molecular weight 402.24063 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(3S,5S,10R,13R,14S,17R)-3,5,14-trihydroxy-10,13-dimethyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pyran-2-one
Also Known As: Telocinobufagin, Telecinobufagin, Telocinobufogenin, KST-1A5106, 3,5,14-Trihydroxybufa-20,22-dienolide
| Molecular Formula | C24H34O5 |
| Molecular Weight | 402.24063 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 402.24063 Da |
| Heavy Atoms | 29 |
| Complexity | 788.0 |
| SMILES | C[C@]12CCC3C([C@]1(CC[C@@H]2C4=COC(=O)C=C4)O)CC[C@]5([C@@]3(CC[C@@H](C5)O)C)O |
| InChIKey | PBSOJKPTQWWJJD-KCDWZGJBSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Telocinobufagin. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Telocinobufagin. Following Lipinski's Rule of Five, Telocinobufagin has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Telocinobufagin is 50262-48-1.
The molecular formula of Telocinobufagin is C24H34O5.
The molecular weight of Telocinobufagin is 402.24063 g/mol.
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