Found 698 results

Search term: MF = 'C_{22}H_{33}N_{5}O_{2}S'
ChemSpider 2D Image | (1-Isobutyl-5-{methyl[(2-methyl-1,3-thiazol-4-yl)methyl]amino}-4,5,6,7-tetrahydro-1H-indazol-3-yl)(4-morpholinyl)methanone | C22H33N5O2S

(1-Isobutyl-5-{methyl[(2-methyl-1,3-thiazol-4-yl)methyl]amino}-4,5,6,7-tetrahydro-1H-indazol-3-yl)(4-morpholinyl)methanone

  • Molecular FormulaC22H33N5O2S
  • Average mass431.595 Da
  • Monoisotopic mass431.235504 Da
  • ChemSpider ID22214241

More details:

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

(1-Isobutyl-5-{methyl[(2-methyl-1,3-thiazol-4-yl)methyl]amino}-4,5,6,7-tetrahydro-1H-indazol-3-yl)(4-morpholinyl)methanon [German] [ACD/IUPAC Name]
(1-Isobutyl-5-{methyl[(2-methyl-1,3-thiazol-4-yl)methyl]amino}-4,5,6,7-tetrahydro-1H-indazol-3-yl)(4-morpholinyl)methanone [ACD/IUPAC Name]
(1-Isobutyl-5-{méthyl[(2-méthyl-1,3-thiazol-4-yl)méthyl]amino}-4,5,6,7-tétrahydro-1H-indazol-3-yl)(4-morpholinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, 4-morpholinyl[4,5,6,7-tetrahydro-5-[methyl[(2-methyl-4-thiazolyl)methyl]amino]-1-(2-methylpropyl)-1H-indazol-3-yl]- [ACD/Index Name]
1-isobutyl-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-3-(4-morpholinylcarbonyl)-4,5,6,7-tetrahydro-1H-indazol-5-amine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 622.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.2±3.0 kJ/mol
Flash Point: 330.2±31.5 °C
Index of Refraction: 1.657
Molar Refractivity: 121.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.54
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.26
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 12.59
ACD/KOC (pH 7.4): 200.31
Polar Surface Area: 92 Å2
Polarizability: 48.0±0.5 10-24cm3
Surface Tension: 49.0±7.0 dyne/cm
Molar Volume: 329.1±7.0 cm3

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