ChemSpider 2D Image | N-[6-({4-[(2-Naphthylmethyl)amino]-1-piperidinyl}carbonyl)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide | C31H34N4O2S

N-[6-({4-[(2-Naphthylmethyl)amino]-1-piperidinyl}carbonyl)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide

  • Molecular FormulaC31H34N4O2S
  • Average mass526.692 Da
  • Monoisotopic mass526.240234 Da
  • ChemSpider ID4438995

More details:

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

Cyclohexanecarboxamide, N-[6-[[4-[(2-naphthalenylmethyl)amino]-1-piperidinyl]carbonyl]-2-benzothiazolyl]- [ACD/Index Name]
N-[6-({4-[(2-Naphthylmethyl)amino]-1-piperidinyl}carbonyl)-1,3-benzothiazol-2-yl]cyclohexancarboxamid [German] [ACD/IUPAC Name]
N-[6-({4-[(2-Naphthylmethyl)amino]-1-piperidinyl}carbonyl)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide [ACD/IUPAC Name]
N-[6-({4-[(2-Naphtylméthyl)amino]-1-pipéridinyl}carbonyl)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide [French] [ACD/IUPAC Name]
N-[6-({4-[(naphthalen-2-ylmethyl)amino]piperidin-1-yl}carbonyl)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide
CHEMBL251945
N-(6-(4-(naphthalen-2-ylmethylamino)piperidine-1-carbonyl)benzo[d]thiazol-2-yl)cyclohexanecarboxamide

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

AIDS227191 [DBID]
AIDS-227191 [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.689
Molar Refractivity: 154.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.14
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 12.88
ACD/KOC (pH 5.5): 39.19
ACD/LogD (pH 7.4): 4.27
ACD/BCF (pH 7.4): 613.54
ACD/KOC (pH 7.4): 1867.50
Polar Surface Area: 103 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 66.5±5.0 dyne/cm
Molar Volume: 405.2±5.0 cm3

Click to predict properties on the Chemicalize site


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