ChemSpider 2D Image | TMC-647055 | C32H38N4O6S

TMC-647055

  • Molecular FormulaC32H38N4O6S
  • Average mass606.732 Da
  • Monoisotopic mass606.251221 Da
  • ChemSpider ID28522119

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

10,6-(Methanoiminothioiminoethanooxyethanoiminomethano)-7H-indolo[2,1-a][2]benzazepine-14,24-dione, 13-cyclohexyl-3-methoxy-17,23-dimethyl-, 16,16-dioxide [ACD/Index Name]
1204416-97-6 [RN]
2,19-Methano-3,7:4,1-dimetheno-1H,11H-14,10,2,9,11,17-benzoxathiatetraazacyclodocosine-8,18(9H,15H)-dione, 27-cyclohexyl-12,13,16,17-tetrahydro-22-methoxy-11,17-dimethyl-, 10,10-dioxide
28-Cyclohexyl-22-methoxy-10,16-dimethyl-13-oxa-9-thia-1,8,10,16-tetraazapentacyclo[16.8.1.12,6.13,26.020,25]nonacosa-2(29),3,5,18,20,22,24,26(28)-octaen-7,17-dion-9,9-dioxid [German] [ACD/IUPAC Name]
28-Cyclohexyl-22-methoxy-10,16-dimethyl-13-oxa-9-thia-1,8,10,16-tetraazapentacyclo[16.8.1.12,6.13,26.020,25]nonacosa-2(29),3,5,18,20,22,24,26(28)-octaene-7,17-dione 9,9-dioxide [ACD/IUPAC Name]
9,9-Dioxyde de 28-cyclohexyl-22-méthoxy-10,16-diméthyl-13-oxa-9-thia-1,8,10,16-tétraazapentacyclo[16.8.1.12,6.13,26.020,25]nonacosa-2(29),3,5,18,20,22,24,26(28)-octaène-7,17-dione [French] [ACD/IUPAC Name]
TMC-647055
113-cyclohexyl-13-methoxy-5,11-dimethyl-17H-8-oxa-4-thia-3,5,11-triaza-1(10,6)-benzo[3,4]azepino[1,2-a]indolacyclododecaphane-2,12-dione 4,4-dioxide
TMC 647055
TMC647055
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

11BD024G7J [DBID]
UNII:11BD024G7J [DBID]
UNII-11BD024G7J [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.669
Molar Refractivity: 163.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 2.99
ACD/BCF (pH 5.5): 83.23
ACD/KOC (pH 5.5): 591.20
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 4.13
ACD/KOC (pH 7.4): 29.33
Polar Surface Area: 119 Å2
Polarizability: 64.8±0.5 10-24cm3
Surface Tension: 54.8±7.0 dyne/cm
Molar Volume: 437.9±7.0 cm3

Click to predict properties on the Chemicalize site






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