ChemSpider 2D Image | N-[2,8-Dichloro-11-(4-methyl-1-piperazinyl)-5H-dibenzo[b,e][1,4]diazepin-5-yl]-2-methylbenzamide | C26H25Cl2N5O

N-[2,8-Dichloro-11-(4-methyl-1-piperazinyl)-5H-dibenzo[b,e][1,4]diazepin-5-yl]-2-methylbenzamide

  • Molecular FormulaC26H25Cl2N5O
  • Average mass494.416 Da
  • Monoisotopic mass493.143616 Da
  • ChemSpider ID23275102

More details:

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

benzamide, N-[2,8-dichloro-11-(4-methyl-1-piperazinyl)-5H-dibenzo[b,e][1,4]diazepin-5-yl]-2-methyl- [ACD/Index Name]
N-[2,8-Dichlor-11-(4-methyl-1-piperazinyl)-5H-dibenzo[b,e][1,4]diazepin-5-yl]-2-methylbenzamid [German] [ACD/IUPAC Name]
N-[2,8-Dichloro-11-(4-methyl-1-piperazinyl)-5H-dibenzo[b,e][1,4]diazepin-5-yl]-2-methylbenzamide [ACD/IUPAC Name]
N-[2,8-Dichloro-11-(4-méthyl-1-pipérazinyl)-5H-dibenzo[b,e][1,4]diazépin-5-yl]-2-méthylbenzamide [French] [ACD/IUPAC Name]
N-[2,8-dichloro-11-(4-methylpiperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepin-5-yl]-2-methylbenzamide
CHEMBL379942
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL379942/
N-[2,8-dichloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,e][1,4]diazepin-5-yl]-2-methyl-benzamide

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: 1.678
Molar Refractivity: 137.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.13
ACD/LogD (pH 5.5): 2.54
ACD/BCF (pH 5.5): 16.35
ACD/KOC (pH 5.5): 68.86
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1041.57
ACD/KOC (pH 7.4): 4385.53
Polar Surface Area: 51 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 51.3±7.0 dyne/cm
Molar Volume: 364.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement