PLANNED MAINTENANCE

There will be scheduled maintenance work beginning on Wednesday 26th February 2020 from 11:00 AM through to 12.00 PM (GMT).

During this time, you may not be able to log into ChemSpider. We apologise for any inconvenience this might cause and thank you for your patience.


ChemSpider 2D Image | amcasertib | C31H33N5O2S

amcasertib

  • Molecular FormulaC31H33N5O2S
  • Average mass539.691 Da
  • Monoisotopic mass539.235474 Da
  • ChemSpider ID44208821
  • Double-bond stereo - Double-bond stereo


More details:






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

10119
1129403-56-0 [RN]
1H-Pyrrole-3-carboxamide, N-[2-(diethylamino)ethyl]-5-[(Z)-[1,2-dihydro-2-oxo-5-(2-phenyl-4-thiazolyl)-3H-indol-3-ylidene]methyl]-2,4-dimethyl- [ACD/Index Name]
amcasertib [INN] [USAN]
amcasertib [French] [INN]
amcasertib [Spanish] [INN]
amcasertibum [Latin] [INN]
BBI503
GLY8ABW25V
N-[2-(Diethylamino)ethyl]-2,4-dimethyl-5-{(Z)-[2-oxo-5-(2-phenyl-1,3-thiazol-4-yl)-1,2-dihydro-3H-indol-3-yliden]methyl}-1H-pyrrol-3-carboxamid [German] [ACD/IUPAC Name]
More...

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.651
Molar Refractivity: 158.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.72
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 2.57
ACD/KOC (pH 5.5): 9.53
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 39.41
ACD/KOC (pH 7.4): 146.28
Polar Surface Area: 118 Å2
Polarizability: 62.7±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 433.1±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement