ChemSpider 2D Image | N-{2-[(4-Methylbenzyl){2-oxo-1-phenyl-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}amino]-2-oxoethyl}-2-thiophenecarboxamide | C28H31N3O4S

N-{2-[(4-Methylbenzyl){2-oxo-1-phenyl-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}amino]-2-oxoethyl}-2-thiophenecarboxamide

  • Molecular FormulaC28H31N3O4S
  • Average mass505.628 Da
  • Monoisotopic mass505.203522 Da
  • ChemSpider ID2466955

More details:

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

2-Thiophenecarboxamide, N-[2-[[(4-methylphenyl)methyl][2-oxo-1-phenyl-2-[[(tetrahydro-2-furanyl)methyl]amino]ethyl]amino]-2-oxoethyl]- [ACD/Index Name]
N-{2-[(4-Methylbenzyl){2-oxo-1-phenyl-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}amino]-2-oxoethyl}-2-thiophencarboxamid [German] [ACD/IUPAC Name]
N-{2-[(4-Methylbenzyl){2-oxo-1-phenyl-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}amino]-2-oxoethyl}-2-thiophenecarboxamide [ACD/IUPAC Name]
N-{2-[(4-Méthylbenzyl){2-oxo-1-phényl-2-[(tétrahydro-2-furanylméthyl)amino]éthyl}amino]-2-oxoéthyl}-2-thiophènecarboxamide [French] [ACD/IUPAC Name]
2-{N-[(4-METHYLPHENYL)METHYL]-2-(THIOPHEN-2-YLFORMAMIDO)ACETAMIDO}-N-(OXOLAN-2-YLMETHYL)-2-PHENYLACETAMIDE
2-{N-[(4-METHYLPHENYL)METHYL]-2-[(THIOPHEN-2-YL)FORMAMIDO]ACETAMIDO}-N-[(OXOLAN-2-YL)METHYL]-2-PHENYLACETAMIDE
Thiophene-2-carboxylic acid [((4-methyl-benzyl)-{phenyl-[(tetrahydro-furan-2-ylmethyl)-carbamoyl]-methyl}-carbamoyl)-methyl]-amide

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

ASN 05990366 [DBID]
MLS000555405 [DBID]
SMR000173253 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 805.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 117.1±3.0 kJ/mol
Flash Point: 440.9±34.3 °C
Index of Refraction: 1.609
Molar Refractivity: 140.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 220.39
ACD/KOC (pH 5.5): 1655.27
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 220.39
ACD/KOC (pH 7.4): 1655.26
Polar Surface Area: 116 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 406.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement