TL;DR: 7-Methyl-3-pentyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one (CAS 138787-13-0) is a chemical compound with molecular formula C15H23N5O5 and molecular weight 353.16992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-3-pentylpyrazolo[4,5-d]triazin-4-one
Also Known As: 7-Methyl-3-pentyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one, 7-Methyl-3-pentyl-5-(beta-D-ribofuranosyl)-5H-pyrazolo[4,3-d]-1,2,3-triazin-4(3H)-one, 7-Methyl-3-pentyl-N5-.beta.-D-ribofuranosylpyrazolo[4,3-d]-1,2,3-triazin-4-one, 5-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-3-pentyl-3H,4H,5H-pyrazolo[4,3-d][1,2,3]triazin-4-one, 5-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-3-pentylpyrazolo[4,3-d]triazin-4-one
| Molecular Formula | C15H23N5O5 |
| Molecular Weight | 353.16992 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 133.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.16992 Da |
| Heavy Atoms | 25 |
| Complexity | 521.0 |
| SMILES | CCCCCN1C(=O)C2=C(C(=NN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)C)N=N1 |
| InChIKey | MUQBKLXSDRHXDI-QGMIFYJMSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Methyl-3-pentyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Methyl-3-pentyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one. Following Lipinski's Rule of Five, 7-Methyl-3-pentyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 7-Methyl-3-pentyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one is 138787-13-0.
The molecular formula of 7-Methyl-3-pentyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one is C15H23N5O5.
The molecular weight of 7-Methyl-3-pentyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one is 353.16992 g/mol.
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