ChemSpider 2D Image | (S)-ly-300168 | C19H20N4O3

(S)-ly-300168

  • Molecular FormulaC19H20N4O3
  • Average mass352.387 Da
  • Monoisotopic mass352.153534 Da
  • ChemSpider ID52085565

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(8S)-5-(4-Aminophenyl)-N,8-dimethyl-8,9-dihydro-7H-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-7-carboxamid [German] [ACD/IUPAC Name]
(8S)-5-(4-Aminophenyl)-N,8-dimethyl-8,9-dihydro-7H-[1,3]dioxolo[4,5-h][2,3]benzodiazepine-7-carboxamide [ACD/IUPAC Name]
(8S)-5-(4-Aminophényl)-N,8-diméthyl-8,9-dihydro-7H-[1,3]dioxolo[4,5-h][2,3]benzodiazépine-7-carboxamide [French] [ACD/IUPAC Name]
(S)-ly-300168
161832-69-5 [RN]
7H-1,3-Dioxolo[4,5-h][2,3]benzodiazepine-7-carboxamide, 5-(4-aminophenyl)-8,9-dihydro-N,8-dimethyl-, (8S)- [ACD/Index Name]
(8S)-5-(4-aminophenyl)-N,8-dimethyl-8,9-dihydro-[1,3]dioxolo[4,5-h][2,3]benzodiazepine-7-carboxamide
7H-1,3-Dioxolo(4,5-H)(2,3)benzodiazepine-7-carboxamide, 5-(4-aminophenyl)-8,9-dihydro-N,8-dimethyl-, (8S)-
LY-300168, (S)-

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

5004185782 [DBID]
UNII:5004185782 [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: 1.687
Molar Refractivity: 95.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.05
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 7.27
ACD/KOC (pH 5.5): 140.13
ACD/LogD (pH 7.4): 1.49
ACD/BCF (pH 7.4): 7.97
ACD/KOC (pH 7.4): 153.75
Polar Surface Area: 89 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 54.4±7.0 dyne/cm
Molar Volume: 249.8±7.0 cm3

Click to predict properties on the Chemicalize site


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