TL;DR: 4H-(1,2,4)Triazino(3,4-a)phthalazine, 3-phenyl-7-(1-pyrrolidinyl)- (CAS 126650-73-5) is a chemical compound with molecular formula C20H19N5 and molecular weight 329.16403 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenyl-7-pyrrolidin-1-yl-4H-[1,2,4]triazino[3,4-a]phthalazine
Also Known As: 3-methylpentyl phenyl sulfone, 3-Phenyl-7-pyrrolidinyl-4H-(1,2,4)triazino(3,4-a)phthalazine, 4H-(1,2,4)Triazino(3,4-a)phthalazine, 3-phenyl-7-(1-pyrrolidinyl)-, 3-phenyl-7-pyrrolidin-1-yl-4H-[1,2,4]triazino[3,4-a]phthalazine, 4H-[1,2,4]Triazino[3,4-a]phthalazine,3-phenyl-7-(1-pyrrolidinyl)-
| Molecular Formula | C20H19N5 |
| Molecular Weight | 329.16403 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 329.16403 Da |
| Heavy Atoms | 25 |
| Complexity | 595.0 |
| SMILES | C1CCN(C1)C2=NN3CC(=NN=C3C4=CC=CC=C42)C5=CC=CC=C5 |
| InChIKey | BWFRJODQJRUKJQ-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 4H-(1,2,4)Triazino(3,4-a)phthalazine, 3-phenyl-7-(1-pyrrolidinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, 4H-(1,2,4)Triazino(3,4-a)phthalazine, 3-phenyl-7-(1-pyrrolidinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-(1,2,4)Triazino(3,4-a)phthalazine, 3-phenyl-7-(1-pyrrolidinyl)- has 0 hydrogen bond donor(s) and 3 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)phthalazine, 3-phenyl-7-(1-pyrrolidinyl)- is 126650-73-5.
The molecular formula of 4H-(1,2,4)Triazino(3,4-a)phthalazine, 3-phenyl-7-(1-pyrrolidinyl)- is C20H19N5.
The molecular weight of 4H-(1,2,4)Triazino(3,4-a)phthalazine, 3-phenyl-7-(1-pyrrolidinyl)- is 329.16403 g/mol.
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