ChemSpider 2D Image | 4-Amino-N~5~-(3,5-dimethylphenyl)-N~5~-{2-[(4-methoxybenzyl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-1,2-thiazole-3,5-dicarboxamide | C30H31N5O5S

4-Amino-N5-(3,5-dimethylphenyl)-N5-{2-[(4-methoxybenzyl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-1,2-thiazole-3,5-dicarboxamide

  • Molecular FormulaC30H31N5O5S
  • Average mass573.663 Da
  • Monoisotopic mass573.204590 Da
  • ChemSpider ID2440055

More details:

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

3,5-Isothiazoledicarboxamide, 4-amino-N5-(3,5-dimethylphenyl)-N5-[1-(4-methoxyphenyl)-2-[[(4-methoxyphenyl)methyl]amino]-2-oxoethyl]- [ACD/Index Name]
4-Amino-N5-(3,5-dimethylphenyl)-N5-{2-[(4-methoxybenzyl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-1,2-thiazol-3,5-dicarboxamid [German] [ACD/IUPAC Name]
4-Amino-N5-(3,5-dimethylphenyl)-N5-{2-[(4-methoxybenzyl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-1,2-thiazole-3,5-dicarboxamide [ACD/IUPAC Name]
4-Amino-N5-(3,5-diméthylphényl)-N5-{2-[(4-méthoxybenzyl)amino]-1-(4-méthoxyphényl)-2-oxoéthyl}-1,2-thiazole-3,5-dicarboxamide [French] [ACD/IUPAC Name]

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

ASN 04451207 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 780.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.6±3.0 kJ/mol
Flash Point: 425.8±32.9 °C
Index of Refraction: 1.663
Molar Refractivity: 160.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 3.83
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 203.77
ACD/KOC (pH 5.5): 1564.93
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 203.77
ACD/KOC (pH 7.4): 1564.93
Polar Surface Area: 178 Å2
Polarizability: 63.4±0.5 10-24cm3
Surface Tension: 61.8±3.0 dyne/cm
Molar Volume: 432.2±3.0 cm3

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