TL;DR: Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-methyl-1-piperazinyl)ethyl)- (CAS 139774-78-0) is a chemical compound with molecular formula C13H18N4O2 and molecular weight 262.14297 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-(4-methylpiperazin-1-yl)ethyl]-[1,3]oxazolo[4,5-b]pyridin-2-one
Also Known As: Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-methyl-1-piperazinyl)ethyl)-, 3-(2-(4-Methyl-1-piperazinyl)ethyl)oxazolo(4,5-b)pyridin-2(3H)-one, 3-[2-(4-Methyl-1-piperazinyl)ethyl]oxazolo[4,5-b]pyridin-2(3H)-one, 3-[2-(4-methylpiperazin-1-yl)ethyl]-[1,3]oxazolo[4,5-b]pyridin-2-one, 3-[2-(4-methylpiperazin-1-yl)ethyl]-2H,3H-[1,3]oxazolo[4,5-b]pyridin-2-one
| Molecular Formula | C13H18N4O2 |
| Molecular Weight | 262.14297 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 48.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.14297 Da |
| Heavy Atoms | 19 |
| Complexity | 331.0 |
| SMILES | CN1CCN(CC1)CCN2C3=C(C=CC=N3)OC2=O |
| InChIKey | KGHUULOEVIKOJK-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-methyl-1-piperazinyl)ethyl)-. With a topological polar surface area (TPSA) of 48.9 Ų, Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-methyl-1-piperazinyl)ethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-methyl-1-piperazinyl)ethyl)- has 0 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 Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-methyl-1-piperazinyl)ethyl)- is 139774-78-0.
The molecular formula of Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-methyl-1-piperazinyl)ethyl)- is C13H18N4O2.
The molecular weight of Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-methyl-1-piperazinyl)ethyl)- is 262.14297 g/mol.
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