Found 301 results

Search term: MF = 'C_{29}H_{30}ClN_{5}O_{4}'
ChemSpider 2D Image | 2-(1H-Benzotriazol-1-yl)-N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-1-(3-hydroxy-4-methoxyphenyl)-2-oxoethyl]acetamide | C29H30ClN5O4

2-(1H-Benzotriazol-1-yl)-N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-1-(3-hydroxy-4-methoxyphenyl)-2-oxoethyl]acetamide

  • Molecular FormulaC29H30ClN5O4
  • Average mass548.033 Da
  • Monoisotopic mass547.198608 Da
  • ChemSpider ID2432955

More details:

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

1H-1,2,3-Benzotriazole-1-acetamide, N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-1-(3-hydroxy-4-methoxyphenyl)-2-oxoethyl]- [ACD/Index Name]
2-(1H-Benzotriazol-1-yl)-N-(4-chlorophenyl)-N-[2-(cyclohexylamino)-1-(3-hydroxy-4-methoxyphenyl)-2-oxoethyl]acetamide [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-(4-chlorophényl)-N-[2-(cyclohexylamino)-1-(3-hydroxy-4-méthoxyphényl)-2-oxoéthyl]acétamide [French] [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-(4-chlorphenyl)-N-[2-(cyclohexylamino)-1-(3-hydroxy-4-methoxyphenyl)-2-oxoethyl]acetamid [German] [ACD/IUPAC Name]

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

ASN 04059857 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 823.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 123.9±3.0 kJ/mol
Flash Point: 452.1±34.3 °C
Index of Refraction: 1.670
Molar Refractivity: 148.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.76
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 757.46
ACD/KOC (pH 5.5): 4005.23
ACD/LogD (pH 7.4): 4.09
ACD/BCF (pH 7.4): 750.00
ACD/KOC (pH 7.4): 3965.75
Polar Surface Area: 110 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 54.9±7.0 dyne/cm
Molar Volume: 398.6±7.0 cm3

Click to predict properties on the Chemicalize site


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