TL;DR: 4-(Diphenylphosphoryl)-N,N-dimethyl-4,4-diphenylbutan-1-amine (CAS 51713-31-6) is a chemical compound with molecular formula C30H32NOP and molecular weight 453.22214 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-diphenylphosphoryl-N,N-dimethyl-4,4-diphenylbutan-1-amine
Also Known As: 4-(diphenylphosphoryl)-n,n-dimethyl-4,4-diphenylbutan-1-amine, Phosphine oxide, diphenyl((alpha-phenyl-alpha-(3-dimethylamino)propyl)benzyl)-, hydrochloride, Phosphine oxide, diphenyl((1,1-diphenyl-4-dimethylamino)butyl)-, 1-(1,1-Diphenyl-4-dimethylaminobutyl)diphenylphosphine oxide hydrochloride, 4-diphenylphosphoryl-N,N-dimethyl-4,4-diphenylbutan-1-amine
| Molecular Formula | C30H32NOP |
| Molecular Weight | 453.22214 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 453.22214 Da |
| Heavy Atoms | 33 |
| Complexity | 567.0 |
| SMILES | CN(C)CCCC(C1=CC=CC=C1)(C2=CC=CC=C2)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | YSDJZUSXOAPETJ-UHFFFAOYSA-N |
The XLogP value of 6.3 indicates that 4-(Diphenylphosphoryl)-N,N-dimethyl-4,4-diphenylbutan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 4-(Diphenylphosphoryl)-N,N-dimethyl-4,4-diphenylbutan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Diphenylphosphoryl)-N,N-dimethyl-4,4-diphenylbutan-1-amine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 4-(Diphenylphosphoryl)-N,N-dimethyl-4,4-diphenylbutan-1-amine is 51713-31-6.
The molecular formula of 4-(Diphenylphosphoryl)-N,N-dimethyl-4,4-diphenylbutan-1-amine is C30H32NOP.
The molecular weight of 4-(Diphenylphosphoryl)-N,N-dimethyl-4,4-diphenylbutan-1-amine is 453.22214 g/mol.
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