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 | (Cyclohexylcarbamoyl)({4-[2-(7-methoxy-4,4-dimethyl-1,3-dioxo-3,4-dihydro-2(1H)-isoquinolinyl)ethyl]phenyl}sulfonyl)azanide | C27H32N3O6S

(Cyclohexylcarbamoyl)({4-[2-(7-methoxy-4,4-dimethyl-1,3-dioxo-3,4-dihydro-2(1H)-isoquinolinyl)ethyl]phenyl}sulfonyl)azanide

  • Molecular FormulaC27H32N3O6S
  • Average mass526.625 Da
  • Monoisotopic mass526.201721 Da
  • ChemSpider ID21240124
  • Charge - Charge


More details:






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

(Cyclohexylcarbamoyl)({4-[2-(7-methoxy-4,4-dimethyl-1,3-dioxo-3,4-dihydro-2(1H)-isochinolinyl)ethyl]phenyl}sulfonyl)azanid [German] [ACD/IUPAC Name]
(Cyclohexylcarbamoyl)({4-[2-(7-méthoxy-4,4-diméthyl-1,3-dioxo-3,4-dihydro-2(1H)-isoquinoléinyl)éthyl]phényl}sulfonyl)azanide [French] [ACD/IUPAC Name]
(Cyclohexylcarbamoyl)({4-[2-(7-methoxy-4,4-dimethyl-1,3-dioxo-3,4-dihydro-2(1H)-isoquinolinyl)ethyl]phenyl}sulfonyl)azanide [ACD/IUPAC Name]
Benzenesulfonamide, N-[(cyclohexylamino)carbonyl]-4-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1H)-isoquinolinyl)ethyl]-, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 34.86
ACD/KOC (pH 5.5): 244.53
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 3.26
ACD/KOC (pH 7.4): 22.86
Polar Surface Area: 118 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






Advertisement