ChemSpider 2D Image | N-[(2Z)-2-(2-Butanylidene)-10-hydroxy-5,11-dimethyl-3,7,12-trioxo-9-(3-pyridinylmethyl)-1,4-dioxa-8-azacyclododecan-6-yl]-3-hydroxy-2-pyridinecarboxamide | C27H32N4O8

N-[(2Z)-2-(2-Butanylidene)-10-hydroxy-5,11-dimethyl-3,7,12-trioxo-9-(3-pyridinylmethyl)-1,4-dioxa-8-azacyclododecan-6-yl]-3-hydroxy-2-pyridinecarboxamide

  • Molecular FormulaC27H32N4O8
  • Average mass540.565 Da
  • Monoisotopic mass540.221985 Da
  • ChemSpider ID4572417

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Pyridinecarboxamide, 3-hydroxy-N-[(2Z)-10-hydroxy-5,11-dimethyl-2-(1-methylpropylidene)-3,7,12-trioxo-9-(3-pyridinylmethyl)-1,4-dioxa-8-azacyclododec-6-yl]- [ACD/Index Name]
N-[(2Z)-2-(2-Butanyliden)-10-hydroxy-5,11-dimethyl-3,7,12-trioxo-9-(3-pyridinylmethyl)-1,4-dioxa-8-azacyclododecan-6-yl]-3-hydroxy-2-pyridincarboxamid [German] [ACD/IUPAC Name]
N-[(2Z)-2-(2-Butanylidene)-10-hydroxy-5,11-dimethyl-3,7,12-trioxo-9-(3-pyridinylmethyl)-1,4-dioxa-8-azacyclododecan-6-yl]-3-hydroxy-2-pyridinecarboxamide [ACD/IUPAC Name]
N-[(2Z)-2-(2-Butanylidène)-10-hydroxy-5,11-diméthyl-3,7,12-trioxo-9-(3-pyridinylméthyl)-1,4-dioxa-8-azacyclododécan-6-yl]-3-hydroxy-2-pyridinecarboxamide [French] [ACD/IUPAC Name]
2-Pyridinecarboxamide, 3-hydroxy-N-[10-hydroxy-5,11-dimethyl-2-(1-methylpropylidene)-3,7,12-trioxo-9-(3-pyridinylmethyl)-1,4-dioxa-8-azacyclododec-6-yl]-, [5R-(2Z,5R*,6S*,9S*,10S*,11R*)]-
pyridomycin

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

NSC246134 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 951.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 145.0±3.0 kJ/mol
Flash Point: 529.0±34.3 °C
Index of Refraction: 1.607
Molar Refractivity: 137.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 0.88
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.26
ACD/LogD (pH 7.4): -1.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 177 Å2
Polarizability: 54.5±0.5 10-24cm3
Surface Tension: 67.4±5.0 dyne/cm
Molar Volume: 398.1±5.0 cm3

Click to predict properties on the Chemicalize site


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