ChemSpider 2D Image | 4-[4-(7-Chloro-4-oxo-6-sulfamoyl-1,2,3,4-tetrahydro-2-quinazolinyl)phenoxy]-1-(2-methyl-3-sulfanylpropanoyl)proline | C23H25ClN4O7S2

4-[4-(7-Chloro-4-oxo-6-sulfamoyl-1,2,3,4-tetrahydro-2-quinazolinyl)phenoxy]-1-(2-methyl-3-sulfanylpropanoyl)proline

  • Molecular FormulaC23H25ClN4O7S2
  • Average mass569.050 Da
  • Monoisotopic mass568.085327 Da
  • ChemSpider ID2342962

More details:

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

4-[4-(7-Chlor-4-oxo-6-sulfamoyl-1,2,3,4-tetrahydro-2-chinazolinyl)phenoxy]-1-(2-methyl-3-sulfanylpropanoyl)prolin [German] [ACD/IUPAC Name]
4-[4-(7-Chloro-4-oxo-6-sulfamoyl-1,2,3,4-tetrahydro-2-quinazolinyl)phenoxy]-1-(2-methyl-3-sulfanylpropanoyl)proline [ACD/IUPAC Name]
4-[4-(7-Chloro-4-oxo-6-sulfamoyl-1,2,3,4-tétrahydro-2-quinazolinyl)phénoxy]-1-(2-méthyl-3-sulfanylpropanoyl)proline [French] [ACD/IUPAC Name]
Proline, 4-[4-[6-(aminosulfonyl)-7-chloro-1,2,3,4-tetrahydro-4-oxo-2-quinazolinyl]phenoxy]-1-(3-mercapto-2-methyl-1-oxopropyl)- [ACD/Index Name]
-(4-(6-(AMINOSULFONYL)-7-CHLORO-1,2,3,4-TETRAHYDRO-4-OXO-2-QUINAZOLINYL)PHENOXY)-1-(3-MERCAPTO- 2-METHYL-1- OXOPROPYL)PROLINE
4-(4-(6-(Aminosulfonyl)-7-chloro-1,2,3,4-tetrahydro-4-oxo-2-quinazolinyl)phenoxy)-1-(3-mercapto-2-methyl-1-oxopropyl)proline
89813-31-0 [RN]

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

SQ 27786 [DBID]
SQ-27786 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.646
Molar Refractivity: 138.1±0.4 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 0.08
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 215 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 65.0±3.0 dyne/cm
Molar Volume: 380.7±3.0 cm3

Click to predict properties on the Chemicalize site


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