Found 1 result

Search term: INCKCPRNUKUIPD-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-Amino-21,23-dimethyl-13-oxa-7-thia-3,5,18-triazatetracyclo[18.3.1.1~2,6~.1~8,12~]hexacosa-1(24),2(26),3,5,8(25),9,11,20,22-nonaen-19-one | C23H24N4O2S

4-Amino-21,23-dimethyl-13-oxa-7-thia-3,5,18-triazatetracyclo[18.3.1.12,6.18,12]hexacosa-1(24),2(26),3,5,8(25),9,11,20,22-nonaen-19-one

  • Molecular FormulaC23H24N4O2S
  • Average mass420.527 Da
  • Monoisotopic mass420.161987 Da
  • ChemSpider ID28489797

More details:

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

13-Oxa-7-thia-3,5,18-triazatetracyclo[18.3.1.12,6.18,12]hexacosa-1(24),2,4,6(26),8,10,12(25),20,22-nonaen-19-one, 4-amino-21,23-dimethyl- [ACD/Index Name]
4-Amino-21,23-dimethyl-13-oxa-7-thia-3,5,18-triazatetracyclo[18.3.1.12,6.18,12]hexacosa-1(24),2(26),3,5,8(25),9,11,20,22-nonaen-19-on [German] [ACD/IUPAC Name]
4-Amino-21,23-dimethyl-13-oxa-7-thia-3,5,18-triazatetracyclo[18.3.1.12,6.18,12]hexacosa-1(24),2(26),3,5,8(25),9,11,20,22-nonaen-19-one [ACD/IUPAC Name]
4-Amino-21,23-diméthyl-13-oxa-7-thia-3,5,18-triazatétracyclo[18.3.1.12,6.18,12]hexacosa-1(24),2(26),3,5,8(25),9,11,20,22-nonaén-19-one [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.620
Molar Refractivity: 120.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 579.39
ACD/KOC (pH 5.5): 3305.88
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 579.63
ACD/KOC (pH 7.4): 3307.22
Polar Surface Area: 115 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 342.1±3.0 cm3

Click to predict properties on the Chemicalize site


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