BEPRIDIL

The 1-Pyrrolidineethanamine,b-[(2-methylpropoxy)methyl]-N-phenyl-N-(phenylmethyl)-, with the CAS registry number 64706-54-3, is also known as 3-Isobutoxy-2-pyrrolidino-N-phenyl-N-benzylpropylamine. It belongs to the product category of Active Pharmaceutical Ingredients. This chemical's molecular formula is C₂₄H₃₄N₂O and molecular weight is 366.5396. Its IUPAC name is called N-benzyl-N-[3-(2-methylpropoxy)-2-pyrrolidin-1-ylpropyl]aniline. This chemical's classification codes are Anti-arrhythmiaagents; Antihypertensiveagents; Calciumchannelblockers; CardiovascularAgents; Drug/TherapeuticAgent; HumanData; MembraneTransportModulators; Vasodilatoragents.

Physical properties of 1-Pyrrolidineethanamine,b-[(2-methylpropoxy)methyl]-N-phenyl-N-(phenylmethyl)-:
(1)ACD/LogP: 5.80; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.81; (4)ACD/LogD (pH 7.4): 4.06; (5)ACD/BCF (pH 5.5): 15.36; (6)ACD/BCF (pH 7.4): 275.94; (7)ACD/KOC (pH 5.5): 34.66; (8)ACD/KOC (pH 7.4): 622.69; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 10; (12)Index of Refraction: 1.572; (13)Molar Refractivity: 114.48 cm³; (14)Molar Volume: 347.7 cm³; (15)Surface Tension: 44.4 dyne/cm; (16)Density: 1.054 g/cm³; (17)Flash Point: 133.2 °C; (18)Enthalpy of Vaporization: 75.92 kJ/mol; (19)Boiling Point: 492.3 °C at 760 mmHg; (20)Vapour Pressure: 7.77E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)COCC(CN(CC1=CC=CC=C1)C2=CC=CC=C2)N3CCCC3
(2)InChI: InChI=1S/C24H34N2O/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3
(3)InChIKey: UIEATEWHFDRYRU-UHFFFAOYSA-N

The toxicity data is as follows: