Found 1 result

Search term: LZTAURWQYWWPLU-ZDUSSCGKSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (7S)-7-Methyl-11-oxa-3,4,6,19,24-pentaazatetracyclo[18.3.1.0~2,6~.0~12,17~]tetracosa-1(24),2,4,12,14,16,20,22-octaen-18-one | C19H19N5O2

(7S)-7-Methyl-11-oxa-3,4,6,19,24-pentaazatetracyclo[18.3.1.02,6.012,17]tetracosa-1(24),2,4,12,14,16,20,22-octaen-18-one

  • Molecular FormulaC19H19N5O2
  • Average mass349.387 Da
  • Monoisotopic mass349.153870 Da
  • ChemSpider ID129189805

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(7S)-7-Methyl-11-oxa-3,4,6,19,24-pentaazatetracyclo[18.3.1.02,6.012,17]tetracosa-1(24),2,4,12,14,16,20,22-octaen-18-on [German] [ACD/IUPAC Name]
(7S)-7-Methyl-11-oxa-3,4,6,19,24-pentaazatetracyclo[18.3.1.02,6.012,17]tetracosa-1(24),2,4,12,14,16,20,22-octaen-18-one [ACD/IUPAC Name]
(7S)-7-Méthyl-11-oxa-3,4,6,19,24-pentaazatétracyclo[18.3.1.02,6.012,17]tétracosa-1(24),2,4,12,14,16,20,22-octaén-18-one [French] [ACD/IUPAC Name]
4,8-Nitrilo-8H-[1,2,4]triazolo[4,3-f][1,6,13]benzoxadiazacyclohexadecin-10(9H)-one, 16,17,18,19-tetrahydro-19-methyl-, (19S)- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4514925/

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: 1.690
Molar Refractivity: 98.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 2.70
ACD/BCF (pH 5.5): 65.92
ACD/KOC (pH 5.5): 697.67
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 65.92
ACD/KOC (pH 7.4): 697.72
Polar Surface Area: 82 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 54.9±7.0 dyne/cm
Molar Volume: 256.9±7.0 cm3

Click to predict properties on the Chemicalize site


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