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Search term: AKDKHZVFMAWBFX-RMORIDSASA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-[(2Z)-2-(1H-Indol-3-ylmethylene)hydrazino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine | C19H17N5S

4-[(2Z)-2-(1H-Indol-3-ylmethylene)hydrazino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

  • Molecular FormulaC19H17N5S
  • Average mass347.437 Da
  • Monoisotopic mass347.120453 Da
  • ChemSpider ID21216375

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Indole-3-carboxaldehyde, 2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)hydrazone [ACD/Index Name]
4-[(2Z)-2-(1H-Indol-3-ylmethylen)hydrazino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin [German] [ACD/IUPAC Name]
4-[(2Z)-2-(1H-Indol-3-ylmethylene)hydrazino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine [ACD/IUPAC Name]
4-[(2Z)-2-(1H-Indol-3-ylméthylène)hydrazino]-5,6,7,8-tétrahydro[1]benzothiéno[2,3-d]pyrimidine [French] [ACD/IUPAC Name]
1H-indole-3-carbaldehyde 5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylhydrazone
N-(1H-INDOL-3-YLMETHYLIDENEAMINO)-5,6,7,8-TETRAHYDRO-[1]BENZOTHIOLO[2,3-D]PYRIMIDIN-4-AMINE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 623.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.4±3.0 kJ/mol
Flash Point: 331.1±31.5 °C
Index of Refraction: 1.805
Molar Refractivity: 100.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.23
ACD/LogD (pH 5.5): 4.93
ACD/BCF (pH 5.5): 2903.01
ACD/KOC (pH 5.5): 9043.64
ACD/LogD (pH 7.4): 5.08
ACD/BCF (pH 7.4): 4129.08
ACD/KOC (pH 7.4): 12863.18
Polar Surface Area: 94 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 64.3±7.0 dyne/cm
Molar Volume: 233.9±7.0 cm3

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