TL;DR: 4H-(1,2,4)Triazino(3,4-a)phthalazin-4-one, 3-methyl-7-(1-pyrrolidinyl)- (CAS 126650-79-1) is a chemical compound with molecular formula C15H15N5O and molecular weight 281.12766 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-7-pyrrolidin-1-yl-[1,2,4]triazino[3,4-a]phthalazin-4-one
Also Known As: 4H-(1,2,4)Triazino(3,4-a)phthalazin-4-one, 3-methyl-7-(1-pyrrolidinyl)-, 3-Methyl-7-(1-pyrrolidinyl)-4H-(1,2,4)triazino(3,4-a)phthalazin-4-one, 3-methyl-7-pyrrolidin-1-yl-[1,2,4]triazino[3,4-a]phthalazin-4-one, 3-METHYL-7-(PYRROLIDIN-1-YL)-4H-[1,2,4]TRIAZINO[3,4-A]PHTHALAZIN-4-ONE
| Molecular Formula | C15H15N5O |
| Molecular Weight | 281.12766 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 60.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.12766 Da |
| Heavy Atoms | 21 |
| Complexity | 558.0 |
| SMILES | CC1=NN=C2C3=CC=CC=C3C(=NN2C1=O)N4CCCC4 |
| InChIKey | MZDMZLMURWMCLI-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-(1,2,4)Triazino(3,4-a)phthalazin-4-one, 3-methyl-7-(1-pyrrolidinyl)-. The TPSA of 60.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-(1,2,4)Triazino(3,4-a)phthalazin-4-one, 3-methyl-7-(1-pyrrolidinyl)-. Following Lipinski's Rule of Five, 4H-(1,2,4)Triazino(3,4-a)phthalazin-4-one, 3-methyl-7-(1-pyrrolidinyl)- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4H-(1,2,4)Triazino(3,4-a)phthalazin-4-one, 3-methyl-7-(1-pyrrolidinyl)- is 126650-79-1.
The molecular formula of 4H-(1,2,4)Triazino(3,4-a)phthalazin-4-one, 3-methyl-7-(1-pyrrolidinyl)- is C15H15N5O.
The molecular weight of 4H-(1,2,4)Triazino(3,4-a)phthalazin-4-one, 3-methyl-7-(1-pyrrolidinyl)- is 281.12766 g/mol.
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