TL;DR: U 80493 (CAS 136816-67-6) is a chemical compound with molecular formula C21H30N4O and molecular weight 354.24197 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-ethyl-2-[4-[(4-methoxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]pyridin-3-amine
Also Known As: U-80493, U 80493, U-80493E, 1-(4-Methoxy-3,5-dimethylbenzyl)-4-(3-(ethylamino)-2-pyridyl)piperazine, 3-Pyridinamine, N-ethyl-2-(4-((4-methoxy-3,5-dimethylphenyl)methyl)-1-piperazinyl)-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H30N4O |
| Molecular Weight | 354.24197 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 40.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.24197 Da |
| Heavy Atoms | 26 |
| Complexity | 401.0 |
| SMILES | CCNC1=C(N=CC=C1)N2CCN(CC2)CC3=CC(=C(C(=C3)C)OC)C |
| InChIKey | ZVJUASLGRLJEDC-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that U 80493 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.6 Ų, U 80493 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, U 80493 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of U 80493 is 136816-67-6.
The molecular formula of U 80493 is C21H30N4O.
The molecular weight of U 80493 is 354.24197 g/mol.
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