ChemSpider 2D Image | 1-(4-Methoxybenzyl)-1-[(7-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]-3-[3-(4-morpholinyl)propyl]thiourea | C27H34N4O4S

1-(4-Methoxybenzyl)-1-[(7-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]-3-[3-(4-morpholinyl)propyl]thiourea

  • Molecular FormulaC27H34N4O4S
  • Average mass510.648 Da
  • Monoisotopic mass510.230072 Da
  • ChemSpider ID2425200

More details:

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

1-(4-Methoxybenzyl)-1-[(7-methoxy-2-oxo-1,2-dihydro-3-chinolinyl)methyl]-3-[3-(4-morpholinyl)propyl]thioharnstoff [German] [ACD/IUPAC Name]
1-(4-Méthoxybenzyl)-1-[(7-méthoxy-2-oxo-1,2-dihydro-3-quinoléinyl)méthyl]-3-[3-(4-morpholinyl)propyl]thiourée [French] [ACD/IUPAC Name]
1-(4-Methoxybenzyl)-1-[(7-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]-3-[3-(4-morpholinyl)propyl]thiourea [ACD/IUPAC Name]
Thiourea, N-[(1,2-dihydro-7-methoxy-2-oxo-3-quinolinyl)methyl]-N-[(4-methoxyphenyl)methyl]-N'-[3-(4-morpholinyl)propyl]- [ACD/Index Name]
3-[(7-METHOXY-2-OXO-1H-QUINOLIN-3-YL)METHYL]-3-[(4-METHOXYPHENYL)METHYL]-1-[3-(MORPHOLIN-4-YL)PROPYL]THIOUREA

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

ASN 03579574 [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: 1.602
Molar Refractivity: 143.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 2.49
ACD/KOC (pH 5.5): 22.65
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 71.08
ACD/KOC (pH 7.4): 647.21
Polar Surface Area: 107 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 418.0±3.0 cm3

Click to predict properties on the Chemicalize site


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