TL;DR: KST-1A5108 (CAS 50276-83-0) is a chemical compound with molecular formula C18H22O2 and molecular weight 270.162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,2S,4S,6S,7S,10S)-7-methyl-5-oxapentacyclo[8.8.0.02,7.04,6.011,16]octadeca-11(16),12,14-trien-14-ol
Also Known As: KST-1A5108, (16, A,17, A)-16,17-epoxyestra-1,3,5(10)-trien-3-ol, Estra-1,3,5(10)-trien-3-ol, 16,17-epoxy-, (16beta,17beta)-
| Molecular Formula | C18H22O2 |
| Molecular Weight | 270.162 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 32.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 270.162 Da |
| Heavy Atoms | 20 |
| Complexity | 422.0 |
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]4[C@H]2O4)CCC5=C3C=CC(=C5)O |
| InChIKey | XPXOJYZDBJGFEI-LMMHAMTPSA-N |
The XLogP value of 4.0 indicates that KST-1A5108 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, KST-1A5108 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1A5108 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of KST-1A5108 is 50276-83-0.
The molecular formula of KST-1A5108 is C18H22O2.
The molecular weight of KST-1A5108 is 270.162 g/mol.
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