ChemSpider 2D Image | N-[(2R)-1-(1,4'-Bipiperidin-1'-yl)-1-oxo-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-2-propanyl]-2'-oxo-2',3'-dihydro-1H,1'H-spiro[piperidine-4,4'-quinazoline]-1-carboxamide | C33H41N7O5

N-[(2R)-1-(1,4'-Bipiperidin-1'-yl)-1-oxo-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-2-propanyl]-2'-oxo-2',3'-dihydro-1H,1'H-spiro[piperidine-4,4'-quinazoline]-1-carboxamide

  • Molecular FormulaC33H41N7O5
  • Average mass615.722 Da
  • Monoisotopic mass615.316895 Da
  • ChemSpider ID9642509

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

N-[(2R)-1-(1,4'-Bipiperidin-1'-yl)-1-oxo-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-2-propanyl]-2'-oxo-2',3'-dihydro-1H,1'H-spiro[piperidine-4,4'-quinazoline]-1-carboxamid [German] [ACD/IUPAC Name]
N-[(2R)-1-(1,4'-Bipiperidin-1'-yl)-1-oxo-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-2-propanyl]-2'-oxo-2',3'-dihydro-1H,1'H-spiro[piperidine-4,4'-quinazoline]-1-carboxamide [ACD/IUPAC Name]
N-[(2R)-1-(1,4'-Bipipéridin-1'-yl)-1-oxo-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-2-propanyl]-2'-oxo-2',3'-dihydro-1H,1'H-spiro[piperidine-4,4'-quinazoline]-1-carboxamide [French] [ACD/IUPAC Name]
Spiro[piperidine-4,4'(1'H)-quinazoline]-1-carboxamide, N-[(1R)-2-[1,4'-bipiperidin]-1'-yl-1-[(2,3-dihydro-2-oxo-6-benzoxazolyl)methyl]-2-oxoethyl]-2',3'-dihydro-2'-oxo- [ACD/Index Name]

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: 1.685
Molar Refractivity: 166.9±0.4 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.78
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 3.57
ACD/KOC (pH 7.4): 25.63
Polar Surface Area: 135 Å2
Polarizability: 66.2±0.5 10-24cm3
Surface Tension: 74.9±5.0 dyne/cm
Molar Volume: 439.0±5.0 cm3

Click to predict properties on the Chemicalize site


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