TL;DR: UPCMLD0ENAT5836603:001 (CAS 872627-98-0) is a chemical compound with molecular formula C18H28N6O4 and molecular weight 392.2172 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[[7-(2-ethoxyethyl)-1,3-dimethyl-2,6-dioxopurin-8-yl]methyl]piperidine-4-carboxamide
Also Known As: UPCMLD0ENAT5836603:001, 1-[[7-(2-ethoxyethyl)-1,3-dimethyl-2,6-dioxopurin-8-yl]methyl]piperidine-4-carboxamide, 1-{[7-(2-ethoxyethyl)-1,3-dimethyl-2,6-dioxo-1,3,7-trihydropurin-8-yl]methyl}p iperidine-4-carboxamide, 1-[[7-(2-ethoxyethyl)-1,3-dimethyl-2,6-dioxo-purin-8-yl]methyl]piperidine-4-carboxamide
| Molecular Formula | C18H28N6O4 |
| Molecular Weight | 392.2172 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.2172 Da |
| Heavy Atoms | 28 |
| Complexity | 609.0 |
| SMILES | CCOCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCC(CC3)C(=O)N |
| InChIKey | JABGHKKDRHZDON-UHFFFAOYSA-N |
The XLogP value of -1.0 indicates that UPCMLD0ENAT5836603:001 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5836603:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5836603:001 has 1 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 UPCMLD0ENAT5836603:001 is 872627-98-0.
The molecular formula of UPCMLD0ENAT5836603:001 is C18H28N6O4.
The molecular weight of UPCMLD0ENAT5836603:001 is 392.2172 g/mol.
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