TL;DR: 9,10-Anthracenedione, 1-[(4-butylphenyl)amino]-4-hydroxy- (CAS 71334-38-8) is a chemical compound with molecular formula C24H21NO3 and molecular weight 371.15213 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-butylanilino)-4-hydroxyanthracene-9,10-dione
Also Known As: KST-1B8266, 1-((4-Butylphenyl)amino)-4-hydroxyanthraquinone, 1-[(4-BUTYLPHENYL)AMINO]-4-HYDROXYANTHRAQUINONE, 1-(4-Butylanilino)-4-hydroxyanthraquinone, 9,10-Anthracenedione, 1-[(4-butylphenyl)amino]-4-hydroxy-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C24H21NO3 |
| Molecular Weight | 371.15213 g/mol |
| XLogP | 7.0 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.15213 Da |
| Heavy Atoms | 28 |
| Complexity | 568.0 |
| SMILES | CCCCC1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O |
| InChIKey | ITLXCSMSIXIRBB-UHFFFAOYSA-N |
The XLogP value of 7.0 indicates that 9,10-Anthracenedione, 1-[(4-butylphenyl)amino]-4-hydroxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 9,10-Anthracenedione, 1-[(4-butylphenyl)amino]-4-hydroxy-. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1-[(4-butylphenyl)amino]-4-hydroxy- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 9,10-Anthracenedione, 1-[(4-butylphenyl)amino]-4-hydroxy- is 71334-38-8.
The molecular formula of 9,10-Anthracenedione, 1-[(4-butylphenyl)amino]-4-hydroxy- is C24H21NO3.
The molecular weight of 9,10-Anthracenedione, 1-[(4-butylphenyl)amino]-4-hydroxy- is 371.15213 g/mol.
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