TL;DR: CCRIS 8204 (CAS 151910-74-6) is a chemical compound with molecular formula C22H18O4 and molecular weight 346.1205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,4S,10S,11S)-3,4,10,11-tetrahydronaphtho[2,1-h]phenanthrene-3,4,10,11-tetrol
Also Known As: Dibenz(a,h)anthracene, 3,4:10,11-tetrahydroxy-3,4,10,11-tetrahydro-, trans,trans-, trans,trans-3,4:10,11-Tetrahydroxy-3,4,10,11-tetrahydro-dibenz(a,h)anthracene, (3S,4S,10S,11S)-3,4,10,11-tetrahydronaphtho[2,1-h]phenanthrene-3,4,10,11-tetrol, 3,4,10,11-Tetrahydro-dibenz(a,H)anthracene-3,4,10,11-tetrol, (3alpha,4beta,10alpha,11beta)-, (3S,4S,10S,11S)-3,4,10,11-Tetrahydrobenzo[k]tetraphene-3,4,10,11-tetrol
| Molecular Formula | C22H18O4 |
| Molecular Weight | 346.1205 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 80.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 346.1205 Da |
| Heavy Atoms | 26 |
| Complexity | 549.0 |
| SMILES | C1=CC2=C(C=CC3=CC4=C(C=CC5=C4C=C[C@@H]([C@H]5O)O)C=C32)[C@@H]([C@H]1O)O |
| InChIKey | FCBQLOHCJAICDK-CMOCDZPBSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CCRIS 8204. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for CCRIS 8204. Following Lipinski's Rule of Five, CCRIS 8204 has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CCRIS 8204 is 151910-74-6.
The molecular formula of CCRIS 8204 is C22H18O4.
The molecular weight of CCRIS 8204 is 346.1205 g/mol.
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