Found 1 result

Search term: CC[C@H](C)[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 | N-[(R)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-L-leucyl-L-isoleucine | C21H34N3O7P

N-[(R)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-L-leucyl-L-isoleucine

  • Molecular FormulaC21H34N3O7P
  • Average mass471.484 Da
  • Monoisotopic mass471.213440 Da
  • ChemSpider ID35034458

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Isoleucine, N-[(R)-hydroxy[(1R)-[[(phenylmethoxy)carbonyl]amino]methyl]phosphinyl]-L-leucyl- [ACD/Index Name]
N-[(R)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-L-leucyl-L-isoleucin [German] [ACD/IUPAC Name]
N-[(R)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-L-leucyl-L-isoleucine [ACD/IUPAC Name]
N-[(R)-({[(Benzyloxy)carbonyl]amino}méthyl)(hydroxy)phosphoryl]-L-leucyl-L-isoleucine [French] [ACD/IUPAC Name]
N-[(S)-({[(Benzyloxy)carbonyl]amino}methyl)(Hydroxy)phosphoryl]-L-Leucyl-L-Isoleucine
UBV

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.533
Molar Refractivity: 118.4±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 2.21
ACD/LogD (pH 5.5): -2.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 164 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 381.7±3.0 cm3

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