ChemSpider 2D Image | N-[(4-Methylphenyl)sulfonyl]glycyl-N-{(2S)-5-[(diaminomethylene)amino]-2-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]pentanoyl}-L-prolinamide | C30H37N7O7S

N-[(4-Methylphenyl)sulfonyl]glycyl-N-{(2S)-5-[(diaminomethylene)amino]-2-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]pentanoyl}-L-prolinamide

  • Molecular FormulaC30H37N7O7S
  • Average mass639.722 Da
  • Monoisotopic mass639.247498 Da
  • ChemSpider ID163734

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

L-Prolinamide, N-[(4-methylphenyl)sulfonyl]glycyl-N-[(2S)-5-[(diaminomethylene)amino]-2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)amino]-1-oxopentyl]- [ACD/Index Name]
N-[(4-Methylphenyl)sulfonyl]glycyl-N-{(2S)-5-[(diaminomethylen)amino]-2-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]pentanoyl}-L-prolinamid [German] [ACD/IUPAC Name]
N-[(4-Methylphenyl)sulfonyl]glycyl-N-{(2S)-5-[(diaminomethylene)amino]-2-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]pentanoyl}-L-prolinamide [ACD/IUPAC Name]
N-[(4-Méthylphényl)sulfonyl]glycyl-N-{(2S)-5-[(diaminométhylène)amino]-2-[(4-méthyl-2-oxo-2H-chromén-7-yl)amino]pentanoyl}-L-prolinamide [French] [ACD/IUPAC Name]
(2S)-5-[(DIAMINOMETHYLIDENE)AMINO]-2-[(4-METHYL-2-OXOCHROMEN-7-YL)AMINO]-N-[(2S)-1-[2-(4-METHYLBENZENESULFONAMIDO)ACETYL]PYRROLIDINE-2-CARBONYL]PENTANAMIDE
117961-27-0 [RN]
Tgpamnh2
Tos-gly-pro-arg-4-methylcoumaryl-7-NH2
Tosyl-glycyl-prolyl-arginyl-4-methylcoumaryl-7-amide

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.677
Molar Refractivity: 164.8±0.5 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 0.69
ACD/LogD (pH 5.5): -0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 224 Å2
Polarizability: 65.3±0.5 10-24cm3
Surface Tension: 62.1±7.0 dyne/cm
Molar Volume: 437.7±7.0 cm3

Click to predict properties on the Chemicalize site


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