ChemSpider 2D Image | PD-1/PD-L1 inhibitor 2 | C25H29N3O3

PD-1/PD-L1 inhibitor 2

  • Molecular FormulaC25H29N3O3
  • Average mass419.516 Da
  • Monoisotopic mass419.220886 Da
  • ChemSpider ID45743495

More details:

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

1675203-84-5 [RN]
Acetamide, N-[2-[[[2-methoxy-6-[(2-methyl[1,1'-biphenyl]-3-yl)methoxy]-3-pyridinyl]methyl]amino]ethyl]- [ACD/Index Name]
N-[2-({[2-methoxy-6-({2-methyl-[1,1'-biphenyl]-3-yl}methoxy)pyridin-3-yl]methyl}amino)ethyl]acetamide
N-{2-[({2-Methoxy-6-[(2-Methyl[1,1'-Biphenyl]-3-Yl)methoxy]pyridin-3-Yl}methyl)amino]ethyl}acetamide
N-{2-[({2-Methoxy-6-[(2-methyl-3-biphenylyl)methoxy]-3-pyridinyl}methyl)amino]ethyl}acetamid [German] [ACD/IUPAC Name]
N-{2-[({2-Methoxy-6-[(2-methyl-3-biphenylyl)methoxy]-3-pyridinyl}methyl)amino]ethyl}acetamide [ACD/IUPAC Name]
N-{2-[({2-Méthoxy-6-[(2-méthyl-3-biphénylyl)méthoxy]-3-pyridinyl}méthyl)amino]éthyl}acétamide [French] [ACD/IUPAC Name]
PD-1/PD-L1 inhibitor 2
(S)-3-amino-1-benzylazepan-2-one;(S)-3-AMINO-1-BENZYL-AZEPAN-2-ONE
6GX
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      Others MedChem Express HY-19745
      PD1-PDL1 inhibitor 2 is a inhibitor of the PD-1 (Programmed death- 1) /PD-Ll (Programmed death-ligand 1) protein/protein interaction, extracted from patent WO/2015034820 A1, compound example 202. MedChem Express HY-19745

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

Density: 1.1±0.1 g/cm3
Boiling Point: 611.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 323.6±31.5 °C
Index of Refraction: 1.575
Molar Refractivity: 122.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 2.95
ACD/BCF (pH 5.5): 62.26
ACD/KOC (pH 5.5): 367.68
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 470.26
ACD/KOC (pH 7.4): 2777.34
Polar Surface Area: 72 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 370.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement