TL;DR: dorsmanin A (CAS 162229-27-8) is a chemical compound with molecular formula C20H20O4 and molecular weight 324.13617 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Also Known As: dorsmanin A, NCI60_040980, 1-(5-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one, (E)-1-(5-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one, 1-(5-hydroxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
| Molecular Formula | C20H20O4 |
| Molecular Weight | 324.13617 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.13617 Da |
| Heavy Atoms | 24 |
| Complexity | 476.0 |
| SMILES | CC1(CCC2=C(O1)C=CC(=C2O)C(=O)C=CC3=CC=C(C=C3)O)C |
| InChIKey | UDSAJERKQRQHJR-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that dorsmanin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for dorsmanin A. Following Lipinski's Rule of Five, dorsmanin A has 2 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 dorsmanin A is 162229-27-8.
The molecular formula of dorsmanin A is C20H20O4.
The molecular weight of dorsmanin A is 324.13617 g/mol.
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