TL;DR: 4-[(Mesitylimino)methyl]benzene-1,3-diol (CAS 120370-69-6) is a chemical compound with molecular formula C16H17NO2 and molecular weight 255.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2,4,6-trimethylphenyl)iminomethyl]benzene-1,3-diol
Also Known As: 4-[(mesitylimino)methyl]benzene-1,3-diol, 4-[(mesitylimino)methyl]-1,3-benzenediol, AN-329/40043629, N-dihydroxybenzylidene-2,4,6-trimethylaminobenzene, 4-{[(2,4,6-trimethylphenyl)imino]methyl}benzene-1,3-diol
| Molecular Formula | C16H17NO2 |
| Molecular Weight | 255.12593 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 52.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.12593 Da |
| Heavy Atoms | 19 |
| Complexity | 306.0 |
| SMILES | CC1=CC(=C(C(=C1)C)N=CC2=C(C=C(C=C2)O)O)C |
| InChIKey | VALFVRSRQPMCBA-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 4-[(Mesitylimino)methyl]benzene-1,3-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.8 Ų, 4-[(Mesitylimino)methyl]benzene-1,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(Mesitylimino)methyl]benzene-1,3-diol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[(Mesitylimino)methyl]benzene-1,3-diol is 120370-69-6.
The molecular formula of 4-[(Mesitylimino)methyl]benzene-1,3-diol is C16H17NO2.
The molecular weight of 4-[(Mesitylimino)methyl]benzene-1,3-diol is 255.12593 g/mol.
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