ChemSpider 2D Image | 2-({2-[(2-Chlorophenyl)amino]-2-oxoethyl}sulfanyl)-3-(2-furylmethyl)-N-(3-isopropoxypropyl)-4-oxo-3,4-dihydro-7-quinazolinecarboxamide | C28H29ClN4O5S

2-({2-[(2-Chlorophenyl)amino]-2-oxoethyl}sulfanyl)-3-(2-furylmethyl)-N-(3-isopropoxypropyl)-4-oxo-3,4-dihydro-7-quinazolinecarboxamide

  • Molecular FormulaC28H29ClN4O5S
  • Average mass569.072 Da
  • Monoisotopic mass568.154724 Da
  • ChemSpider ID5048394

More details:

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

2-({2-[(2-Chlorophenyl)amino]-2-oxoethyl}sulfanyl)-3-(2-furylmethyl)-N-(3-isopropoxypropyl)-4-oxo-3,4-dihydro-7-quinazolinecarboxamide [ACD/IUPAC Name]
2-({2-[(2-Chlorophényl)amino]-2-oxoéthyl}sulfanyl)-3-(2-furylméthyl)-N-(3-isopropoxypropyl)-4-oxo-3,4-dihydro-7-quinazolinecarboxamide [French] [ACD/IUPAC Name]
2-({2-[(2-Chlorphenyl)amino]-2-oxoethyl}sulfanyl)-3-(2-furylmethyl)-N-(3-isopropoxypropyl)-4-oxo-3,4-dihydro-7-chinazolincarboxamid [German] [ACD/IUPAC Name]
7-Quinazolinecarboxamide, 2-[[2-[(2-chlorophenyl)amino]-2-oxoethyl]thio]-3-(2-furanylmethyl)-3,4-dihydro-N-[3-(1-methylethoxy)propyl]-4-oxo- [ACD/Index Name]

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

ChemDiv1_013392 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.642
Molar Refractivity: 151.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 305.79
ACD/KOC (pH 5.5): 2092.55
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 305.79
ACD/KOC (pH 7.4): 2092.52
Polar Surface Area: 139 Å2
Polarizability: 60.2±0.5 10-24cm3
Surface Tension: 51.9±7.0 dyne/cm
Molar Volume: 420.4±7.0 cm3

Click to predict properties on the Chemicalize site


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