L-Leucine,N-[2-(1H-indol-3-yl)acetyl]- (36838-63-8)

The cas register number of N-(3-Indolylacetyl)-L-leucine is 36838-63-8. It also can be called as L-Leucine,N-[2-(1H-indol-3-yl)acetyl]- and the Systematic name about this chemical is N-(1H-indol-3-ylacetyl)leucine. It belongs to the Indoles and derivatives.

Physical properties about N-(3-Indolylacetyl)-L-leucine are: (1)ACD/LogP: 1.86; (2)ACD/LogD (pH 5.5): -0.17; (3)ACD/LogD (pH 7.4): -1.67; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 2.31; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 5; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 51.54Ų; (12)Index of Refraction: 1.605; (13)Molar Refractivity: 80.98 cm³; (14)Molar Volume: 235 cm³; (15)Polarizability: 32.1x10^-24cm³; (16)Surface Tension: 53.4 dyne/cm; (17)Enthalpy of Vaporization: 92.77 kJ/mol; (18)Vapour Pressure: 7.87E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C(NC(=O)Cc2c1ccccc1nc2)CC(C)C
(2)InChI: InChI=1/C16H20N2O3/c1-10(2)7-14(16(20)21)18-15(19)8-11-9-17-13-6-4-3-5-12(11)13/h3-6,9-10,14,17H,7-8H2,1-2H3,(H,18,19)(H,20,21)
(3)InChIKey: HCZNPUHZYPPINM-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C16H20N2O3/c1-10(2)7-14(16(20)21)18-15(19)8-11-9-17-13-6-4-3-5-12(11)13/h3-6,9-10,14,17H,7-8H2,1-2H3,(H,18,19)(H,20,21)
(5)Std. InChIKey: HCZNPUHZYPPINM-UHFFFAOYSA-N