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Molecular formula

C42H45ClN6O5S2

2 compounds have this formula on CompoundList.

Molar mass
813.43g/mol
Monoisotopic mass
820.3084Da
Atoms
101
Elements
6
Rings plus double bonds
23

The formula C42H45ClN6O5S2 describes a molecule made of 42 carbon atoms, 45 hydrogen atoms, 1 chlorine atom, 6 nitrogen atoms, 5 oxygen atoms and 2 sulfur atoms. It is written in Hill notation: carbon first, then hydrogen, then the other elements in alphabetical order. The formula tells you which atoms are present, not how they are connected, which is why several different chemicals can share it.

Elemental composition

  • C Carbon × 4262.02%
    12.011 × 42 = 504.462 g/mol
  • H Hydrogen × 455.58%
    1.008 × 45 = 45.360 g/mol
  • Cl Chlorine × 14.36%
    35.45 × 1 = 35.450 g/mol
  • N Nitrogen × 610.33%
    14.007 × 6 = 84.042 g/mol
  • O Oxygen × 59.83%
    15.999 × 5 = 79.995 g/mol
  • S Sulfur × 27.88%
    32.06 × 2 = 64.120 g/mol
Look up another formula

Compounds with the formula C42H45ClN6O5S2

Isomers we list, best known first. Open one to see its structure, properties, safety data and suppliers.

Showing 1 to 2 of 2 compounds

4-(4-((4'-Chloro(1,1'-biphenyl)-2-yl)methyl)-1-piperazinyl)-N-((4-(((1R)-3-(dimethylamino)-1-((phenylthio)methyl)propyl)amino)-3-nitrophenyl)sulfonyl)benzamide chemical structure, C42H45ClN6O5S2, CAS 852808-04-9
4-(4-((4'-Chloro(1,1'-biphenyl)-2-yl)methyl)-1-piperazinyl)-N-((4-(((1R)-3-(dimethylamino)-1-((phenylthio)methyl)propyl)amino)-3-nitrophenyl)sulfonyl)benzamide
CAS 852808-04-9C42H45ClN6O5S2
ABT 737-d8 chemical structure, C42H45ClN6O5S2, CAS 1217686-68-4
ABT 737-d8
CAS 1217686-68-4C42H45ClN6O5S2

Frequently asked questions

What is the molar mass of C42H45ClN6O5S2?

The molar mass of C42H45ClN6O5S2 is 813.43 g/mol, calculated from standard atomic weights for 42 carbon atoms, 45 hydrogen atoms, 1 chlorine atom, 6 nitrogen atoms, 5 oxygen atoms and 2 sulfur atoms. The monoisotopic mass is 820.3084 Da.

How many compounds have the formula C42H45ClN6O5S2?

CompoundList lists 2 compounds with the molecular formula C42H45ClN6O5S2, including 4-(4-((4'-Chloro(1,1'-biphenyl)-2-yl)methyl)-1-piperazinyl)-N-((4-(((1R)-3-(dimethylamino)-1-((phenylthio)methyl)propyl)amino)-3-nitrophenyl)sulfonyl)benzamide, ABT 737-d8. Compounds that share a formula are isomers. They contain the same atoms arranged differently, so their properties, uses and prices can be very different.

What is the degree of unsaturation of C42H45ClN6O5S2?

C42H45ClN6O5S2 has a degree of unsaturation of 23. That is the total number of rings and pi bonds (a double bond counts as one, a triple bond as two) in any structure with this formula.