ChemSpider 2D Image | N-((1R,2R)-2-(5-CHLORO-1H-INDOLE-2-CARBOXAMIDO)CYCLOHEXYL)-5-METHYL-4,5,6,7-TETRAHYDROTHIAZOLO[5,4-C]PYRIDINE-2-CARBOXAMIDE | C23H26ClN5O2S

N-((1R,2R)-2-(5-CHLORO-1H-INDOLE-2-CARBOXAMIDO)CYCLOHEXYL)-5-METHYL-4,5,6,7-TETRAHYDROTHIAZOLO[5,4-C]PYRIDINE-2-CARBOXAMIDE

  • Molecular FormulaC23H26ClN5O2S
  • Average mass472.003 Da
  • Monoisotopic mass471.149567 Da
  • ChemSpider ID23305566

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

N-((1R,2R)-2-(5-CHLORO-1H-INDOLE-2-CARBOXAMIDO)CYCLOHEXYL)-5-METHYL-4,5,6,7-TETRAHYDROTHIAZOLO[5,4-C]PYRIDINE-2-CARBOXAMIDE
N-[(1R,2R)-2-{[(5-Chlor-1H-indol-2-yl)carbonyl]amino}cyclohexyl]-5-methyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-carboxamid [German] [ACD/IUPAC Name]
N-[(1R,2R)-2-{[(5-Chloro-1H-indol-2-yl)carbonyl]amino}cyclohexyl]-5-methyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridine-2-carboxamide [ACD/IUPAC Name]
N-[(1R,2R)-2-{[(5-Chloro-1H-indol-2-yl)carbonyl]amino}cyclohexyl]-5-méthyl-4,5,6,7-tétrahydro[1,3]thiazolo[5,4-c]pyridine-2-carboxamide [French] [ACD/IUPAC Name]
Thiazolo[5,4-c]pyridine-2-carboxamide, N-[(1R,2R)-2-[[(5-chloro-1H-indol-2-yl)carbonyl]amino]cyclohexyl]-4,5,6,7-tetrahydro-5-methyl- [ACD/Index Name]
5-chloro-N-[(1R,2R)-2-{5-methyl-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine-2-amido}cyclohexyl]-1H-indole-2-carboxamide
5-chloro-N-[(1R,2R)-2-{5-methyl-4H,6H,7H-[1,3]thiazolo[5,4-c]pyridine-2-amido}cyclohexyl]-1H-indole-2-carboxamide
CHEMBL391805
D93
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL391805/
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.691
Molar Refractivity: 126.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.92
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 17.56
ACD/KOC (pH 5.5): 114.92
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 286.66
ACD/KOC (pH 7.4): 1876.23
Polar Surface Area: 118 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 73.7±5.0 dyne/cm
Molar Volume: 330.6±5.0 cm3

Click to predict properties on the Chemicalize site


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