(4-Methoxyphenyl)(1-pentyl-1H-indol-3-yl)methanone

The (4-Methoxyphenyl)(1-pentyl-1H-indol-3-yl)methanone, with the CAS registry number 1345966-78-0, is also known as 1-Pentyl-3-(4-methoxybenzoyl)indole. This chemical's molecular formula is C₂₁H₂₃NO₂ and molecular weight is 321.41. What's more, its systematic name is 2-(4-Methoxyphenyl)-1-(1-pentyl-indol-3-yl)methanone. This chemical is a synthetic cannabinoid drug sold under the names SR-19, BTM-4, or Eric-4 (later shortened to E-4), but originally, OBT-199. As with all other research chemicals, human use is not encouraged or recommended. Little data exist on this drug, and even without solid data chronic usage is recommended against.

Physical properties of (4-Methoxyphenyl)(1-pentyl-1H-indol-3-yl)methanone are: (1)ACD/LogP: 5.679; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.68; (4)ACD/LogD (pH 7.4): 5.68; (5)ACD/BCF (pH 5.5): 12186.05; (6)ACD/BCF (pH 7.4): 12186.05; (7)ACD/KOC (pH 5.5): 29258.33; (8)ACD/KOC (pH 7.4): 29258.33; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 31.23 Å²; (13)Index of Refraction: 1.568; (14)Molar Refractivity: 97.508 cm³; (15)Molar Volume: 297.891 cm³; (16)Polarizability: 38.655×10^-24cm³; (17)Surface Tension: 39.06 dyne/cm; (18)Density: 1.079 g/cm³; (19)Flash Point: 252.044 °C; (20)Enthalpy of Vaporization: 76.022 kJ/mol; (21)Boiling Point: 493.142 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCCCn1cc(c2c1cccc2)C(=O)c3ccc(cc3)OC
(2)Std. InChI: InChI=1S/C21H23NO2/c1-3-4-7-14-22-15-19(18-8-5-6-9-20(18)22)21(23)16-10-12-17(24-2)13-11-16/h5-6,8-13,15H,3-4,7,14H2,1-2H3
(3)Std. InChIKey: OZCYJKDWRUIFFE-UHFFFAOYSA-N