Found 1 result

Search term: CVMUHXWSBHMVGZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-[4-(1,3-Benzothiazol-2-yl)phenoxy]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]quinazoline | C30H31N5O3S

4-[4-(1,3-Benzothiazol-2-yl)phenoxy]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]quinazoline

  • Molecular FormulaC30H31N5O3S
  • Average mass541.664 Da
  • Monoisotopic mass541.214783 Da
  • ChemSpider ID10173113

More details:

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

4-[4-(1,3-Benzothiazol-2-yl)phenoxy]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]chinazolin [German] [ACD/IUPAC Name]
4-[4-(1,3-Benzothiazol-2-yl)phenoxy]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]quinazoline [ACD/IUPAC Name]
4-[4-(1,3-Benzothiazol-2-yl)phénoxy]-6-méthoxy-7-[3-(4-méthyl-1-pipérazinyl)propoxy]quinazoline [French] [ACD/IUPAC Name]
Quinazoline, 4-[4-(2-benzothiazolyl)phenoxy]-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 710.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.9±3.0 kJ/mol
Flash Point: 383.5±35.7 °C
Index of Refraction: 1.652
Molar Refractivity: 156.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 3.92
ACD/KOC (pH 5.5): 21.46
ACD/LogD (pH 7.4): 3.49
ACD/BCF (pH 7.4): 195.59
ACD/KOC (pH 7.4): 1070.70
Polar Surface Area: 101 Å2
Polarizability: 62.1±0.5 10-24cm3
Surface Tension: 56.1±3.0 dyne/cm
Molar Volume: 428.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement