TL;DR: 4-amino-N-(2-((2,4,5-trimethoxybenzyl)amino)ethyl)-1,2,5-oxadiazole-3-carboxamide hydrochloride (CAS 1052525-59-3) is a chemical compound with molecular formula C15H22ClN5O5 and molecular weight 387.13095 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-N-[2-[(2,4,5-trimethoxyphenyl)methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide;hydrochloride
Also Known As: 4-amino-N-(2-((2,4,5-trimethoxybenzyl)amino)ethyl)-1,2,5-oxadiazole-3-carboxamide hydrochloride, 4-amino-N-[2-[(2,4,5-trimethoxyphenyl)methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide hydrochloride
| Molecular Formula | C15H22ClN5O5 |
| Molecular Weight | 387.13095 g/mol |
| XLogP | 0.619 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 387.13095 Da |
| Heavy Atoms | 26 |
| Complexity | 416.0 |
| SMILES | COC1=CC(=C(C=C1CNCCNC(=O)C2=NON=C2N)OC)OC.Cl |
| InChIKey | LLPQXTRKOFODFQ-UHFFFAOYSA-N |
The XLogP value of 0.619 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-amino-N-(2-((2,4,5-trimethoxybenzyl)amino)ethyl)-1,2,5-oxadiazole-3-carboxamide hydrochloride. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-amino-N-(2-((2,4,5-trimethoxybenzyl)amino)ethyl)-1,2,5-oxadiazole-3-carboxamide hydrochloride. Following Lipinski's Rule of Five, 4-amino-N-(2-((2,4,5-trimethoxybenzyl)amino)ethyl)-1,2,5-oxadiazole-3-carboxamide hydrochloride has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-amino-N-(2-((2,4,5-trimethoxybenzyl)amino)ethyl)-1,2,5-oxadiazole-3-carboxamide hydrochloride is 1052525-59-3.
The molecular formula of 4-amino-N-(2-((2,4,5-trimethoxybenzyl)amino)ethyl)-1,2,5-oxadiazole-3-carboxamide hydrochloride is C15H22ClN5O5.
The molecular weight of 4-amino-N-(2-((2,4,5-trimethoxybenzyl)amino)ethyl)-1,2,5-oxadiazole-3-carboxamide hydrochloride is 387.13095 g/mol.
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