ChemSpider 2D Image | N-(Cyclopropylsulfonyl)-1-({(Z)-hydroxy[(24E)-25-hydroxy-7-methoxy-24-(2-methyl-2-propanyl)-22-oxo-2,21-dioxa-4,11,23,26-tetraazapentacyclo[24.2.1.0~3,12~.0~5,10~.0~18,20~]nonacosa-3(12),4,6,8,10,24-h exaen-27-ylidene]methyl}amino)-2-vinylcyclopropanecarboxamide | C38H50N6O9S

N-(Cyclopropylsulfonyl)-1-({(Z)-hydroxy[(24E)-25-hydroxy-7-methoxy-24-(2-methyl-2-propanyl)-22-oxo-2,21-dioxa-4,11,23,26-tetraazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3(12),4,6,8,10,24-h exaen-27-ylidene]methyl}amino)-2-vinylcyclopropanecarboxamide

  • Molecular FormulaC38H50N6O9S
  • Average mass766.903 Da
  • Monoisotopic mass766.335999 Da
  • ChemSpider ID95642022

  • Double-bond stereo - Double-bond stereo

More details:

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

Cyclopropanecarboxamide, N-(cyclopropylsulfonyl)-1-[[(Z)-[(5E)-5-(1,1-dimethylethyl)-1,1a,3,4,9,10,18,19,20,21,22,22a-dodecahydro-6-hydroxy-14-methoxy-3-oxo-8H-7,10-methanocyclopropa[18,19][1,10,3,6]d ioxadiazacyclononadecino[11,12-b]quinoxalin-8-ylidene]hydroxymethyl]amino]-2-ethenyl- [ACD/Index Name]
N-(Cyclopropylsulfonyl)-1-({(Z)-hydroxy[(24E)-25-hydroxy-7-methoxy-24-(2-methyl-2-propanyl)-22-oxo-2,21-dioxa-4,11,23,26-tetraazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3(12),4,6,8,10,24-h ;exaen-27-yliden]methyl}amino)-2-vinylcyclopropancarboxamid [German] [ACD/IUPAC Name]
N-(Cyclopropylsulfonyl)-1-({(Z)-hydroxy[(24E)-25-hydroxy-7-methoxy-24-(2-methyl-2-propanyl)-22-oxo-2,21-dioxa-4,11,23,26-tetraazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3(12),4,6,8,10,24-h ;exaen-27-ylidene]methyl}amino)-2-vinylcyclopropanecarboxamide [ACD/IUPAC Name]
N-(Cyclopropylsulfonyl)-1-({(Z)-hydroxy[(24E)-25-hydroxy-7-méthoxy-24-(2-méthyl-2-propanyl)-22-oxo-2,21-dioxa-4,11,23,26-tétraazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3(12),4,6,8,10,24-h ;exaén-27-ylidène]méthyl}amino)-2-vinylcyclopropanecarboxamide [French] [ACD/IUPAC Name]

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: 1.662
Molar Refractivity: 199.4±0.4 cm3
#H bond acceptors: 15
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 4
ACD/LogP: 6.75
ACD/LogD (pH 5.5): 5.18
ACD/BCF (pH 5.5): 3908.44
ACD/KOC (pH 5.5): 9498.70
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 185.37
ACD/KOC (pH 7.4): 450.51
Polar Surface Area: 210 Å2
Polarizability: 79.0±0.5 10-24cm3
Surface Tension: 73.7±5.0 dyne/cm
Molar Volume: 538.9±5.0 cm3

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