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Search term: XYBMWPVGMYNSHV-UHFFFAOYSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 1-[(4-Amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-propyl-3-pyrrolidinol | C14H23N5O

1-[(4-Amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-propyl-3-pyrrolidinol

  • Molecular FormulaC14H23N5O
  • Average mass277.365 Da
  • Monoisotopic mass277.190247 Da
  • ChemSpider ID23257249

More details:






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

1-[(4-Amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-propyl-3-pyrrolidinol [German] [ACD/IUPAC Name]
1-[(4-Amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-propyl-3-pyrrolidinol [ACD/IUPAC Name]
1-[(4-Amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)méthyl]-4-propyl-3-pyrrolidinol [French] [ACD/IUPAC Name]
1-[(4-amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-propylpyrrolidin-3-ol
3-Pyrrolidinol, 1-[(4-amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-propyl- [ACD/Index Name]
1-(4-Amino-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-7-ylmethyl)-4-propyl-pyrrolidin-3-ol
CHEMBL189911

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 460.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.0±3.0 kJ/mol
Flash Point: 232.3±31.5 °C
Index of Refraction: 1.718
Molar Refractivity: 75.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.75
ACD/LogD (pH 5.5): -4.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 90 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 59.4±7.0 dyne/cm
Molar Volume: 190.6±7.0 cm3

Click to predict properties on the Chemicalize site





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