TL;DR: SK 31694 (CAS 131486-57-2) is a chemical compound with molecular formula C22H12O3 and molecular weight 324.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
21-oxahexacyclo[12.9.0.03,12.04,9.017,23.020,22]tricosa-1(14),2,4,6,8,10,12,15,17(23),18,20(22)-undecaene-18,19-diol
Also Known As: SK 31694, Dibenz(a,j)anthracene trans-3,4-diol-syn-1,2-epoxide, (+)-anti-Dibenz(a,j)anthracene-3,4-diol-1,2-epoxide, Benzo[10,11]tetrapheno[1,2-b]oxirene-2,3-diol, 21-Oxahexacyclo[12.9.0.03,12.04,9.017,23.020,22]tricosa-1(14),2,4,6,8,10,12,15,17(23),18,20(22)-undecaene-18,19-diol
| Molecular Formula | C22H12O3 |
| Molecular Weight | 324.07864 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 324.07864 Da |
| Heavy Atoms | 25 |
| Complexity | 535.0 |
| SMILES | C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)C5=C(C=C4)C(=C(C6=C5O6)O)O |
| InChIKey | OJBNDAXVHCPIAC-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that SK 31694 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, SK 31694 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, SK 31694 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of SK 31694 is 131486-57-2.
The molecular formula of SK 31694 is C22H12O3.
The molecular weight of SK 31694 is 324.07864 g/mol.
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