C32H37NO6S

3-[[6-(2-carboxyethenyl)-5-[8-(4-methoxyphenyl)octoxy]-2-pyridinyl]methylsulfanylmethyl]benzoic acid

Also Known As: ACMC-20n5z0|CTK4C6627|CTK8H0321|QQUXZUFSDIOIFJ-UHFFFAOYSA-N|SB 201993|Benzoic acid,3-[[[[6-[(1E)-2-carboxyethenyl]-5-[[8-(4-methoxyphenyl)octyl]oxy]-2-pyridinyl]methyl]thio]methyl]-|(E)-3-((((6-(2-Carboxyethenyl)-5-((8-(4-methoxyphenyl)octyl)oxy)-2-pyridinyl)methyl)thio)methyl)benzoic acid

Molecular Formula	C32H37NO6S
Molecular Weight	563.23413 g/mol
LogP	7.28
Topological Polar Surface Area	105.95 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	18
Exact Mass	563.23413
Heavy Atoms	40
Complexity	1258.5

Chemical Identifiers

CAS Number	150399-22-7
SMILES	COC1=CC=C(C=C1)CCCCCCCCOC2=C(N=C(C=C2)CSCC3=CC(=CC=C3)C(=O)O)C=CC(=O)O