Imidazo[2,1-b]thiazole-5-carboxylicacid, 6-methyl- (77628-51-4)

The 6-Methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid, with the cas registry number 77628-51-4, is also called imidazo[2,1-b]thiazole-5-carboxylic acid, 6-methyl-. It belongs to the following product categories: Carboxylic Acids; Carboxylic Acids; Fused Ring Systems. And the molecular formula of the chemical is C₇H₆N₂O₂S.

The characteristics of this chemical are as followings: (1)ACD/LogP: 2.42; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 71.84 Å²; (7)Index of Refraction: 1.76; (8)Molar Refractivity: 46.04 cm³; (9)Molar Volume: 111.8 cm³; (10)Polarizability: 18.25×10^-24cm³; (11)Surface Tension: 68.8 dyne/cm; (12)Density: 1.62 g/cm³.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(O)c1n2ccsc2nc1C
(2)InChI: InChI=1/C7H6N2O2S/c1-4-5(6(10)11)9-2-3-12-7(9)8-4/h2-3H,1H3,(H,10,11)
(3)InChIKey: VSQMBZXCDDTZAF-UHFFFAOYAI