Found 153 results

Search term: MF = 'C_{18}H_{11}ClN_{4}OS'
ChemSpider 2D Image | 3-(4-CHLOROPHENYL)-9-(2-PROPYN-1-YLAMINO)PYRIDO(3',2':4,5)THIENO(3,2-D)PYRIMIDIN-4(3H)-ONE | C18H11ClN4OS

3-(4-CHLOROPHENYL)-9-(2-PROPYN-1-YLAMINO)PYRIDO(3',2':4,5)THIENO(3,2-D)PYRIMIDIN-4(3H)-ONE

  • Molecular FormulaC18H11ClN4OS
  • Average mass366.824 Da
  • Monoisotopic mass366.034210 Da
  • ChemSpider ID26399103

More details:

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

3-(4-CHLOROPHENYL)-9-(2-PROPYN-1-YLAMINO)PYRIDO(3',2':4,5)THIENO(3,2-D)PYRIMIDIN-4(3H)-ONE
3-(4-Chlorophenyl)-9-(2-propyn-1-ylamino)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one [ACD/IUPAC Name]
3-(4-Chlorophényl)-9-(2-propyn-1-ylamino)pyrido[3',2':4,5]thiéno[3,2-d]pyrimidin-4(3H)-one [French] [ACD/IUPAC Name]
3-(4-Chlorphenyl)-9-(2-propin-1-ylamino)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-on [German] [ACD/IUPAC Name]
Pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one, 3-(4-chlorophenyl)-9-(2-propyn-1-ylamino)- [ACD/Index Name]
5-(4-chlorophenyl)-13-[(prop-2-yn-1-yl)amino]-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
5-(4-chlorophenyl)-13-[(prop-2-yn-1-yl)amino]-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
902747-93-7 [RN]
compound 11q [PMID: 19433355]
compound 11q [PMID:19433355]
More...

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

Density: 1.4±0.1 g/cm3
Boiling Point: 632.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.4±34.3 °C
Index of Refraction: 1.733
Molar Refractivity: 101.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.22
ACD/LogD (pH 5.5): 1.49
ACD/BCF (pH 5.5): 2.65
ACD/KOC (pH 5.5): 18.82
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 94.45
ACD/KOC (pH 7.4): 670.85
Polar Surface Area: 86 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 58.2±7.0 dyne/cm
Molar Volume: 253.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement