ChemSpider 2D Image | VRT-325 | C27H34N4O4S

VRT-325

  • Molecular FormulaC27H34N4O4S
  • Average mass510.648 Da
  • Monoisotopic mass510.230072 Da
  • ChemSpider ID10132079

More details:

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

4-(Cyclohexyloxy)-2-(1-(4-((4-methoxyphenyl)sulfonyl)piperazin-1-yl)ethyl)quinazoline
4-(Cyclohexyloxy)-2-(1-{4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl}ethyl)chinazolin [German] [ACD/IUPAC Name]
4-(Cyclohexyloxy)-2-(1-{4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl}ethyl)quinazoline [ACD/IUPAC Name]
4-(Cyclohexyloxy)-2-(1-{4-[(4-méthoxyphényl)sulfonyl]-1-pipérazinyl}éthyl)quinazoline [French] [ACD/IUPAC Name]
4-cyclohexyloxy-2-(1-(4-(4-methoxy-benzenesulfonyl)piperazin-1-yl)ethyl)quinazoline
815592-21-3 [RN]
Quinazoline, 4-(cyclohexyloxy)-2-[1-[4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl]ethyl]- [ACD/Index Name]
VRT-325
4-(Cyclohexyloxy)-2-(1-(4-(4-methoxyphenylsulfonyl)piperazin-1-yl)ethyl)quinazoline
4-(CYCLOHEXYLOXY)-2-(1-(4-[(4-METHOXYBENZENE)SULFONYL]PIPERAZIN-1-YL)ETHYL)QUINAZOLINE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

VX-809 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 618.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 327.6±34.3 °C
Index of Refraction: 1.617
Molar Refractivity: 140.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.94
ACD/LogD (pH 5.5): 4.62
ACD/BCF (pH 5.5): 1827.73
ACD/KOC (pH 5.5): 7189.20
ACD/LogD (pH 7.4): 4.68
ACD/BCF (pH 7.4): 2140.96
ACD/KOC (pH 7.4): 8421.25
Polar Surface Area: 93 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 402.5±3.0 cm3

Click to predict properties on the Chemicalize site


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