TL;DR: 2-Propen-1-one, 1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)- (CAS 106522-97-8) is a chemical compound with molecular formula C15H10BrNO5 and molecular weight 362.97424 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)prop-2-en-1-one
Also Known As: Acrylophenone, 5'-bromo-2',4'-dihydroxy-3-(m-nitrophenyl)-, 2-Propen-1-one, 1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)-, 1-(5-Bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)-2-propen-1-one, (E)-1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)prop-2-en-1-one
| Molecular Formula | C15H10BrNO5 |
| Molecular Weight | 362.97424 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.97424 Da |
| Heavy Atoms | 22 |
| Complexity | 450.0 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)C2=CC(=C(C=C2O)O)Br |
| InChIKey | BEUOXKNBSIXVCX-SNAWJCMRSA-N |
The XLogP value of 4.1 indicates that 2-Propen-1-one, 1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propen-1-one, 1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)-. Following Lipinski's Rule of Five, 2-Propen-1-one, 1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)- has 2 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 2-Propen-1-one, 1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)- is 106522-97-8.
The molecular formula of 2-Propen-1-one, 1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)- is C15H10BrNO5.
The molecular weight of 2-Propen-1-one, 1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)- is 362.97424 g/mol.
You can request a quote for 2-Propen-1-one, 1-(5-bromo-2,4-dihydroxyphenyl)-3-(3-nitrophenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
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