TL;DR: Naphthol AS-MX butyrate (CAS 137629-33-5) is a chemical compound with molecular formula C23H23NO3 and molecular weight 361.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-[(2,4-dimethylphenyl)carbamoyl]naphthalen-2-yl] butanoate
Also Known As: Naphthol AS-MX butyrate, NAPHTHOLAS-MXBUTYRATE, [3-[(2,4-dimethylphenyl)carbamoyl]naphthalen-2-yl] Butanoate, 3-[(2,4-dimethylphenyl)carbamoyl]naphthalen-2-yl butanoate, 3-[N-(2,4-dimethylphenyl)carbamoyl]-2-naphthyl butanoate
| Molecular Formula | C23H23NO3 |
| Molecular Weight | 361.1678 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.1678 Da |
| Heavy Atoms | 27 |
| Complexity | 520.0 |
| SMILES | CCCC(=O)OC1=CC2=CC=CC=C2C=C1C(=O)NC3=C(C=C(C=C3)C)C |
| InChIKey | OSBXUQZQTBGULF-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that Naphthol AS-MX butyrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Naphthol AS-MX butyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthol AS-MX butyrate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Naphthol AS-MX butyrate is 137629-33-5.
The molecular formula of Naphthol AS-MX butyrate is C23H23NO3.
The molecular weight of Naphthol AS-MX butyrate is 361.1678 g/mol.
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