CCT129202 supplier | CasNO.942947-93-5

Name
CCT129202
EINECS
CAS No. 942947-93-5
Density 1.427 g/cm³
Solubility
Melting Point
Formula C₂₃H₂₅ClN₈OS
Boiling Point
Molecular Weight 497.02
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms CCT129202
PSA 125.01000
LogP 4.21390

CCT129202 Specification

The CCT129202 is an organic compound with the formula C₂₃H₂₅ClN₈OS. With the CAS registry number 942947-93-5, the systematic name of this chemical is 2-(4-{6-chloro-2-[4-(dimethylamino)phenyl]-1H-imidazo[4,5-b]pyridin-7-yl}piperazin-1-yl)-N-1,3-thiazol-2-ylacetamide.

Physical properties about CCT129202 are: (1)ACD/LogP: 4.94; (2)ACD/LogD (pH 5.5): 2.52; (3)ACD/LogD (pH 7.4): 3.71; (4)ACD/BCF (pH 5.5): 12.86; (5)ACD/BCF (pH 7.4): 198.16; (6)ACD/KOC (pH 5.5): 44.55; (7)ACD/KOC (pH 7.4): 686.6; (8)#H bond acceptors: 9; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 101.87 Å²; (12)Index of Refraction: 1.718; (13)Molar Refractivity: 137.29 cm³; (14)Molar Volume: 348.1 cm³; (15)Polarizability: 54.42×10^-24cm³; (16)Surface Tension: 75.4 dyne/cm; (17)Density: 1.427 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1nccs1)CN5CCN(c2c3nc(nc3ncc2Cl)c4ccc(N(C)C)cc4)CC5
(2)InChI: InChI=1/C23H25ClN8OS/c1-30(2)16-5-3-15(4-6-16)21-28-19-20(17(24)13-26-22(19)29-21)32-10-8-31(9-11-32)14-18(33)27-23-25-7-12-34-23/h3-7,12-13H,8-11,14H2,1-2H3,(H,25,27,33)(H,26,28,29)
(3)InChIKey: QYKHWEFPFAGNEV-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C23H25ClN8OS/c1-30(2)16-5-3-15(4-6-16)21-28-19-20(17(24)13-26-22(19)29-21)32-10-8-31(9-11-32)14-18(33)27-23-25-7-12-34-23/h3-7,12-13H,8-11,14H2,1-2H3,(H,25,27,33)(H,26,28,29)
(5)Std. InChIKey: QYKHWEFPFAGNEV-UHFFFAOYSA-N

Product Name

CCT129202

CCT129202 Specification

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