TL;DR: N-isobutyl-N-(4-methoxyphenylsulfonyl)glycyl hydroxamic acid (CAS 161314-17-6) is a chemical compound with molecular formula C13H20N2O5S and molecular weight 316.10928 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]acetamide
Also Known As: NNGH, mmp-3 inhibitor ii, 1rmz, MMP Inhibitor Set I, 1z3j
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H20N2O5S |
| Molecular Weight | 316.10928 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 316.10928 Da |
| Heavy Atoms | 21 |
| Complexity | 424.0 |
| SMILES | CC(C)CN(CC(=O)NO)S(=O)(=O)C1=CC=C(C=C1)OC |
| InChIKey | JIRXORZYIXSWOB-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isobutyl-N-(4-methoxyphenylsulfonyl)glycyl hydroxamic acid. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-isobutyl-N-(4-methoxyphenylsulfonyl)glycyl hydroxamic acid. Following Lipinski's Rule of Five, N-isobutyl-N-(4-methoxyphenylsulfonyl)glycyl hydroxamic acid has 2 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 N-isobutyl-N-(4-methoxyphenylsulfonyl)glycyl hydroxamic acid is 161314-17-6.
The molecular formula of N-isobutyl-N-(4-methoxyphenylsulfonyl)glycyl hydroxamic acid is C13H20N2O5S.
The molecular weight of N-isobutyl-N-(4-methoxyphenylsulfonyl)glycyl hydroxamic acid is 316.10928 g/mol.
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