Found 1 result

Search term: CC[C@H](NC(=O)[C@H](CC(C)C)N[P@@](O)(=O)CNC(=O)OCc1ccccc1)C(O)=O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | (2s)-2-({n-[(R)-({[(Benzyloxy)carbonyl]amino}methyl)(Hydroxy)phosphoryl]-L-Leucyl}amino)butanoic Acid | C19H30N3O7P

(2s)-2-({n-[(R)-({[(Benzyloxy)carbonyl]amino}methyl)(Hydroxy)phosphoryl]-L-Leucyl}amino)butanoic Acid

  • Molecular FormulaC19H30N3O7P
  • Average mass443.431 Da
  • Monoisotopic mass443.182129 Da
  • ChemSpider ID35034460

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2s)-2-({n-[(R)-({[(Benzyloxy)carbonyl]amino}methyl)(Hydroxy)phosphoryl]-L-Leucyl}amino)butanoic Acid
(2S)-2-({N-[(S)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-L-leucyl}amino)butanoic acid [ACD/IUPAC Name]
(2S)-2-({N-[(S)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-L-leucyl}amino)butansäure [German] [ACD/IUPAC Name]
Acide (2S)-2-({N-[(S)-({[(benzyloxy)carbonyl]amino}méthyl)(hydroxy)phosphoryl]-L-leucyl}amino)butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2-[[(2S)-2-[[(S)-hydroxy[(1S)-[[(phenylmethoxy)carbonyl]amino]methyl]phosphinyl]amino]-4-methyl-1-oxopentyl]amino]-, (2S)- [ACD/Index Name]
UBZ

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.540
Molar Refractivity: 109.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 1.34
ACD/LogD (pH 5.5): -3.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 164 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 52.6±3.0 dyne/cm
Molar Volume: 348.3±3.0 cm3

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