ChemSpider 2D Image | Methyl 5-[(1S,2S)-2-chloro-1-{[(4R)-1-methyl-4-propyl-L-prolyl]amino}propyl]-2-O-phosphono-1-thio-beta-L-lyxopyranoside | C18H34ClN2O8PS

Methyl 5-[(1S,2S)-2-chloro-1-{[(4R)-1-methyl-4-propyl-L-prolyl]amino}propyl]-2-O-phosphono-1-thio-β-L-lyxopyranoside

  • Molecular FormulaC18H34ClN2O8PS
  • Average mass504.963 Da
  • Monoisotopic mass504.146210 Da
  • ChemSpider ID32697262

  • defined stereocentres - 8 of 9 defined stereocentres

More details:

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

5-[(1S,2S)-2-Chloro-1-{[(4R)-1-méthyl-4-propyl-L-prolyl]amino}propyl]-2-O-phosphono-1-thio-β-L-lyxopyranoside de méthyle [French] [ACD/IUPAC Name]
L-glycero-α-D-gulo-Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-[[[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-, 2-(dihydrogen phosphate), (5ξ)- [ACD/Index Name]
Methyl 5-[(1S,2S)-2-chloro-1-{[(4R)-1-methyl-4-propyl-L-prolyl]amino}propyl]-2-O-phosphono-1-thio-β-L-lyxopyranoside [ACD/IUPAC Name]
Methyl-5-[(1S,2S)-2-chlor-1-{[(4R)-1-methyl-4-propyl-L-prolyl]amino}propyl]-2-O-phosphono-1-thio-β-L-lyxopyranosid [German] [ACD/IUPAC Name]
24729-96-2 [RN]
Clindamycin 2-dihydrogen phosphate
GF2625000
MFCD07793328 [MDL number]

    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: 1.577
    Molar Refractivity: 118.0±0.4 cm3
    #H bond acceptors: 10
    #H bond donors: 5
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 3
    ACD/LogP: 0.93
    ACD/LogD (pH 5.5): -2.12
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.89
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 184 Å2
    Polarizability: 46.8±0.5 10-24cm3
    Surface Tension: 63.5±5.0 dyne/cm
    Molar Volume: 355.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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