ChemSpider 2D Image | lenacapavir | C39H32ClF10N7O5S2

lenacapavir

  • Molecular FormulaC39H32ClF10N7O5S2
  • Average mass968.282 Da
  • Monoisotopic mass967.143494 Da
  • ChemSpider ID81367881

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1H-Cyclopropa[3,4]cyclopenta[1,2-c]pyrazole-1-acetamide, N-[(1S)-1-[3-[4-chloro-3-[(methylsulfonyl)amino]-1-(2,2,2-trifluoroethyl)-1H-indazol-7-yl]-6-[3-methyl-3-(methylsulfonyl)-1-butyn-1-yl]-2-pyrid inyl]-2-(3,5-difluorophenyl)ethyl]-5,5-difluoro-3b,4,4a,5-tetrahydro-3-(trifluoromethyl)-, (3bS,4aR)- [ACD/Index Name]
lenacapavir [INN] [USAN]
N-[(1S)-1-(3-{4-Chlor-3-[(methylsulfonyl)amino]-1-(2,2,2-trifluorethyl)-1H-indazol-7-yl}-6-[3-methyl-3-(methylsulfonyl)-1-butin-1-yl]-2-pyridinyl)-2-(3,5-difluorphenyl)ethyl]-2-[(3bS,4aR)-5,5-difluor- 3-(trifluormethyl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazol-1-yl]acetamid [German] [ACD/IUPAC Name]
N-[(1S)-1-(3-{4-Chloro-3-[(methylsulfonyl)amino]-1-(2,2,2-trifluoroethyl)-1H-indazol-7-yl}-6-[3-methyl-3-(methylsulfonyl)-1-butyn-1-yl]-2-pyridinyl)-2-(3,5-difluorophenyl)ethyl]-2-[(3bS,4aR)-5,5-diflu oro-3-(trifluoromethyl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazol-1-yl]acetamide [ACD/IUPAC Name]
N-[(1S)-1-(3-{4-Chloro-3-[(méthylsulfonyl)amino]-1-(2,2,2-trifluoroéthyl)-1H-indazol-7-yl}-6-[3-méthyl-3-(méthylsulfonyl)-1-butyn-1-yl]-2-pyridinyl)-2-(3,5-difluorophényl)éthyl]-2-[(3bS,4aR)-5,5-diflu oro-3-(trifluorométhyl)-3b,4,4a,5-tétrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazol-1-yl]acétamide [French] [ACD/IUPAC Name]
Sunlenca [Trade name]
2189684-44-2 [RN]
GS-6207
N-[(1S)-1-[3-[4-chloro-3-(methanesulfonamido)-1-(2,2,2-trifluoroethyl)indazol-7-yl]-6-(3-methyl-3-methylsulfonylbut-1-ynyl)pyridin-2-yl]-2-(3,5-difluorophenyl)ethyl]-2-[(2S,4R)-5,5-difluoro-9-(trifluoromethyl)-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetamide

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.631
Molar Refractivity: 212.7±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 6.02
ACD/LogD (pH 5.5): 4.88
ACD/BCF (pH 5.5): 1770.01
ACD/KOC (pH 5.5): 3929.21
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 183.09
ACD/KOC (pH 7.4): 406.44
Polar Surface Area: 175 Å2
Polarizability: 84.3±0.5 10-24cm3
Surface Tension: 47.9±7.0 dyne/cm
Molar Volume: 597.3±7.0 cm3

Click to predict properties on the Chemicalize site


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