ChemSpider 2D Image | (2E)-2-Cyano-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[4-(hexyloxy)-3-methoxyphenyl]acrylamide | C28H31N3O4S

(2E)-2-Cyano-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[4-(hexyloxy)-3-methoxyphenyl]acrylamide

  • Molecular FormulaC28H31N3O4S
  • Average mass505.628 Da
  • Monoisotopic mass505.203522 Da
  • ChemSpider ID4649362

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-Cyan-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[4-(hexyloxy)-3-methoxyphenyl]acrylamid [German] [ACD/IUPAC Name]
(2E)-2-Cyano-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[4-(hexyloxy)-3-methoxyphenyl]acrylamide [ACD/IUPAC Name]
(2E)-2-Cyano-N-[4-(4-éthoxyphényl)-1,3-thiazol-2-yl]-3-[4-(hexyloxy)-3-méthoxyphényl]acrylamide [French] [ACD/IUPAC Name]
2-Propenamide, 2-cyano-N-[4-(4-ethoxyphenyl)-2-thiazolyl]-3-[4-(hexyloxy)-3-methoxyphenyl]-, (2E)- [ACD/Index Name]
(2E)-2-cyano-N-[4-(4-ethoxyphenyl)(1,3-thiazol-2-yl)]-3-(4-hexyloxy-3-methoxyphenyl)prop-2-enamide
(E)-2-cyano-N-(4-(4-ethoxyphenyl)thiazol-2-yl)-3-(4-(hexyloxy)-3-methoxyphenyl)acrylamide
(E)-2-cyano-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-(4-hexoxy-3-methoxyphenyl)prop-2-enamide
464904-21-0 [RN]

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

ZINC04290131 [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 144.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 7.16
ACD/LogD (pH 5.5): 5.63
ACD/BCF (pH 5.5): 6974.26
ACD/KOC (pH 5.5): 11244.10
ACD/LogD (pH 7.4): 4.55
ACD/BCF (pH 7.4): 588.62
ACD/KOC (pH 7.4): 949.00
Polar Surface Area: 122 Å2
Polarizability: 57.3±0.5 10-24cm3
Surface Tension: 49.3±3.0 dyne/cm
Molar Volume: 420.1±3.0 cm3

Click to predict properties on the Chemicalize site


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