Found 13 results

Search term: MF = 'C_{38}H_{47}N_{3}O_{2}'
ChemSpider 2D Image | (2S)-2-Cycloheptyl-2-{4-[(2,4-dimethyl-6,7,8,9-tetrahydrocyclohepta[4,5]pyrrolo[2,3-b]pyridin-10(5H)-yl)methyl]phenyl}-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide | C38H47N3O2

(2S)-2-Cycloheptyl-2-{4-[(2,4-dimethyl-6,7,8,9-tetrahydrocyclohepta[4,5]pyrrolo[2,3-b]pyridin-10(5H)-yl)methyl]phenyl}-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide

  • Molecular FormulaC38H47N3O2
  • Average mass577.799 Da
  • Monoisotopic mass577.366821 Da
  • ChemSpider ID8091869

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-2-Cycloheptyl-2-{4-[(2,4-dimethyl-6,7,8,9-tetrahydrocyclohepta[4,5]pyrrolo[2,3-b]pyridin-10(5H)-yl)methyl]phenyl}-N-[(1R)-2-hydroxy-1-phenylethyl]acetamid [German] [ACD/IUPAC Name]
(2S)-2-Cycloheptyl-2-{4-[(2,4-dimethyl-6,7,8,9-tetrahydrocyclohepta[4,5]pyrrolo[2,3-b]pyridin-10(5H)-yl)methyl]phenyl}-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide [ACD/IUPAC Name]
(2S)-2-Cycloheptyl-2-{4-[(2,4-diméthyl-6,7,8,9-tétrahydrocyclohepta[4,5]pyrrolo[2,3-b]pyridin-10(5H)-yl)méthyl]phényl}-N-[(1R)-2-hydroxy-1-phényléthyl]acétamide [French] [ACD/IUPAC Name]
Cycloheptaneacetamide, N-[(1R)-2-hydroxy-1-phenylethyl]-α-[4-[(6,7,8,9-tetrahydro-2,4-dimethylcyclohepta[4,5]pyrrolo[2,3-b]pyridin-10(5H)-yl)methyl]phenyl]-, (αS)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 814.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 124.1±3.0 kJ/mol
Flash Point: 446.4±34.3 °C
Index of Refraction: 1.635
Molar Refractivity: 173.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 9.60
ACD/LogD (pH 5.5): 6.26
ACD/BCF (pH 5.5): 10787.46
ACD/KOC (pH 5.5): 6954.10
ACD/LogD (pH 7.4): 7.81
ACD/BCF (pH 7.4): 383682.06
ACD/KOC (pH 7.4): 247339.17
Polar Surface Area: 67 Å2
Polarizability: 68.9±0.5 10-24cm3
Surface Tension: 45.9±7.0 dyne/cm
Molar Volume: 485.2±7.0 cm3

Click to predict properties on the Chemicalize site


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