Found 1 result

Search term: 21248045 (Found by CSID)
ChemSpider 2D Image | N-Acetyl-S-[(1,3-dihydroxy-6-methoxy-7-methyl-5,8-dioxo-5,8-dihydro-2-naphthalenyl)methyl]-L-cysteine | C18H19NO8S

N-Acetyl-S-[(1,3-dihydroxy-6-methoxy-7-methyl-5,8-dioxo-5,8-dihydro-2-naphthalenyl)methyl]-L-cysteine

  • Molecular FormulaC18H19NO8S
  • Average mass409.410 Da
  • Monoisotopic mass409.083130 Da
  • ChemSpider ID21248045

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Cysteine, N-acetyl-S-[(5,8-dihydro-1,3-dihydroxy-6-methoxy-7-methyl-5,8-dioxo-2-naphthalenyl)methyl]- [ACD/Index Name]
N-Acétyl-S-[(1,3-dihydroxy-6-méthoxy-7-méthyl-5,8-dioxo-5,8-dihydro-2-naphtalényl)méthyl]-L-cystéine [French] [ACD/IUPAC Name]
N-Acetyl-S-[(1,3-dihydroxy-6-methoxy-7-methyl-5,8-dioxo-5,8-dihydro-2-naphthalenyl)methyl]-L-cysteine [ACD/IUPAC Name]
N-Acetyl-S-[(1,3-dihydroxy-6-methoxy-7-methyl-5,8-dioxo-5,8-dihydro-2-naphthalinyl)methyl]-L-cystein [German] [ACD/IUPAC Name]
Fibrostatin D

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

Density: 1.5±0.1 g/cm3
Boiling Point: 776.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.6±3.0 kJ/mol
Flash Point: 423.6±32.9 °C
Index of Refraction: 1.656
Molar Refractivity: 98.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.89
ACD/LogD (pH 5.5): -1.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 176 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 79.9±5.0 dyne/cm
Molar Volume: 267.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement