TL;DR: 4'-Acetamido-2'-carboxy-4-dimethylamino-2-hydroxybenzophenone (CAS 166442-36-0) is a chemical compound with molecular formula C18H18N2O5 and molecular weight 342.12158 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-acetamido-2-[4-(dimethylamino)-2-hydroxybenzoyl]benzoic acid
Also Known As: 4'-ACETAMIDO-2'-CARBOXY-4-DIMETHYLAMINO-2-HYDROXYBENZOPHENONE, 5-acetamido-2-[4-(dimethylamino)-2-hydroxybenzoyl]benzoic acid, Benzoic acid, 5-(acetylamino)-2-[4-(dimethylamino)-2-hydroxybenzoyl]-, 5-(Acetylamino)-2-[4-(dimethylamino)-2-hydroxybenzoyl]benzoic Acid, ?4Acetamido-2carboxy-4-dimethylamino-2-hydroxybenzophenone
| Molecular Formula | C18H18N2O5 |
| Molecular Weight | 342.12158 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.12158 Da |
| Heavy Atoms | 25 |
| Complexity | 522.0 |
| SMILES | CC(=O)NC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)N(C)C)O)C(=O)O |
| InChIKey | RLVHXZUZNQEOCM-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that 4'-Acetamido-2'-carboxy-4-dimethylamino-2-hydroxybenzophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Acetamido-2'-carboxy-4-dimethylamino-2-hydroxybenzophenone. Following Lipinski's Rule of Five, 4'-Acetamido-2'-carboxy-4-dimethylamino-2-hydroxybenzophenone has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4'-Acetamido-2'-carboxy-4-dimethylamino-2-hydroxybenzophenone is 166442-36-0.
The molecular formula of 4'-Acetamido-2'-carboxy-4-dimethylamino-2-hydroxybenzophenone is C18H18N2O5.
The molecular weight of 4'-Acetamido-2'-carboxy-4-dimethylamino-2-hydroxybenzophenone is 342.12158 g/mol.
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