TL;DR: P,P-Bis(1-aziridinyl)-N'-isopropylidene-N-methylphosphinic hydrazide (CAS 100853-80-3) is a chemical compound with molecular formula C8H17N4OP and molecular weight 216.114 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[bis(aziridin-1-yl)phosphoryl]-N-(propan-2-ylideneamino)methanamine
Also Known As: J1.598.337J, 1-Methyl-1-[bis(1-aziridinyl)phosphinyl]-2-isopropylidenehydrazine, N-[bis(aziridin-1-yl)phosphoryl]-N-(propan-2-ylideneamino)methanamine, P,P-Bis(1-aziridinyl)-N'-isopropylidene-N-methylphosphinic hydrazide, P,P-Bis(aziridin-1-yl)-N-methyl-N'-(propan-2-ylidene)phosphinic hydrazide
| Molecular Formula | C8H17N4OP |
| Molecular Weight | 216.114 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 216.114 Da |
| Heavy Atoms | 14 |
| Complexity | 288.0 |
| SMILES | CC(=NN(C)P(=O)(N1CC1)N2CC2)C |
| InChIKey | BMBMMLFHCSZQSS-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for P,P-Bis(1-aziridinyl)-N'-isopropylidene-N-methylphosphinic hydrazide. With a topological polar surface area (TPSA) of 38.7 Ų, P,P-Bis(1-aziridinyl)-N'-isopropylidene-N-methylphosphinic hydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, P,P-Bis(1-aziridinyl)-N'-isopropylidene-N-methylphosphinic hydrazide has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of P,P-Bis(1-aziridinyl)-N'-isopropylidene-N-methylphosphinic hydrazide is 100853-80-3.
The molecular formula of P,P-Bis(1-aziridinyl)-N'-isopropylidene-N-methylphosphinic hydrazide is C8H17N4OP.
The molecular weight of P,P-Bis(1-aziridinyl)-N'-isopropylidene-N-methylphosphinic hydrazide is 216.114 g/mol.
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