TL;DR: Phosphine oxide, (1-aziridinyl)(2-methyl-1-aziridinyl)diallylamino- (CAS 41657-19-6) is a chemical compound with molecular formula C11H20N3OP and molecular weight 241.1344 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[aziridin-1-yl-(2-methylaziridin-1-yl)phosphoryl]-N-prop-2-enylprop-2-en-1-amine
Also Known As: phosphineoxide, Phosphinic amide,N-di-2-propenyl-, AI3-61569, Phosphine oxide, (1-aziridinyl)(2-methyl-1-aziridinyl)diallylamino-, (1-Aziridinyl)(2-methyl-1-aziridinyl)diallylaminophosphine oxide
| Molecular Formula | C11H20N3OP |
| Molecular Weight | 241.1344 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 241.1344 Da |
| Heavy Atoms | 16 |
| Complexity | 330.0 |
| SMILES | CC1CN1P(=O)(N2CC2)N(CC=C)CC=C |
| InChIKey | LXCIHXPVYQKJAG-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphine oxide, (1-aziridinyl)(2-methyl-1-aziridinyl)diallylamino-. With a topological polar surface area (TPSA) of 26.3 Ų, Phosphine oxide, (1-aziridinyl)(2-methyl-1-aziridinyl)diallylamino- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphine oxide, (1-aziridinyl)(2-methyl-1-aziridinyl)diallylamino- 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 Phosphine oxide, (1-aziridinyl)(2-methyl-1-aziridinyl)diallylamino- is 41657-19-6.
The molecular formula of Phosphine oxide, (1-aziridinyl)(2-methyl-1-aziridinyl)diallylamino- is C11H20N3OP.
The molecular weight of Phosphine oxide, (1-aziridinyl)(2-methyl-1-aziridinyl)diallylamino- is 241.1344 g/mol.
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