Product Name

4-[(5-Amino-1-methyl-1H-indol-3-yl)methyl]-3-methoxy-N-[(2-methylphenyl)sulfonyl]benzamide Specification

This chemical is called 4-[(5-Amino-1-methyl-1H-indol-3-yl)methyl]-3-methoxy-N-[(2-methylphenyl)sulfonyl]benzamide. With the molecular formula of C25H25N3O4S, its molecular weight is 463.55. The CAS registry number of this chemical is 219583-10-5.

Other characteristics of the 4-[(5-Amino-1-methyl-1H-indol-3-yl)methyl]-3-methoxy-N-[(2-methylphenyl)sulfonyl]benzamide can be summarised as followings: (1)ACD/LogP: 3.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 15; (6)ACD/BCF (pH 7.4): 5; (7)ACD/KOC (pH 5.5): 90; (8)ACD/KOC (pH 7.4): 30; (9)#H bond acceptors: 7; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 111.8 Å2; (13)Index of Refraction: 1.642; (14)Molar Refractivity: 127.932 cm3; (15)Molar Volume: 354.339 cm3; (16)Polarizability: 50.716×10-24cm3; (17)Surface Tension: 50.564 dyne/cm; (18)Density: 1.308 g/cm3.

You can still convert the following datas into molecular structure: 
1.SMILES: O=S(=O)(c1ccccc1C)NC(=O)c2ccc(c(OC)c2)Cc4c3cc(ccc3n(c4)C)N
2.InChI: InChI=1/C25H25N3O4S/c1-16-6-4-5-7-24(16)33(30,31)27-25(29)18-9-8-17(23(13-18)32-3)12-19-15-28(2)22-11-10-20(26)14-21(19)22/h4-11,13-15H,12,26H2,1-3H3,(H,27,29)3.InChIKey: HNBZIIQASMYNPG-UHFFFAOYAN

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