potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide

C225H238BBrCl9FI2KN31O27 — CID 159728711

IUPACpotassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide
SMILESC.C=C(C)C(=O)OCCNC(=O)CCc1ccc(-c2cc(C(C)(C)C)cc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.C=C(C)C(=O)OCCNC(=O)CCc1ccc(-c2cccc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.CC(C)(C)c1cc(-c2ccc(CCC(=O)NCCO)cc2)c(O)c(-n2nc3ccc(Cl)cc3n2)c1.CC(C)(C)c1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(B2OC(C)(C)C(C)(C)O2)c(O)c(-n2nc3ccc(Cl)cc3n2)c1.CC(C)(C)c1cc(Br)c(O)c(-n2nc3ccc(Cl)cc3n2)c1.COC(=O)CCc1ccc(-c2cc(C(C)(C)C)cc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.COC(=O)CCc1ccc(-c2cccc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.COC(=O)CCc1ccc(I)cc1.F.I.O=C(CCc1ccc(-c2cccc(-n3nc4ccc(Cl)cc4n3)c2O)cc1)NCCO.[H-].[H][H].[K+]
InChIInChI=1S/C31H33ClN4O4.C27H25ClN4O4.C27H29ClN4O3.C26H26ClN3O3.C23H21ClN4O3.C22H27BClN3O3.C22H18ClN3O3.C20H24ClN3O.C16H15BrClN3O.C10H11IO2.CH4.FH.HI.K.H2.H/c1-19(2)30(39)40-15-14-33-28(37)13-8-20-6-9-21(10-7-20)24-16-22(31(3,4)5)17-27(29(24)38)36-34-25-12-11-23(32)18-26(25)35-36;1-17(2)27(35)36-15-14-29-25(33)13-8-18-6-9-19(10-7-18)21-4-3-5-24(26(21)34)32-30-22-12-11-20(28)16-23(22)31-32;1-27(2,3)19-14-21(18-7-4-17(5-8-18)6-11-25(34)29-12-13-33)26(35)24(15-19)32-30-22-10-9-20(28)16-23(22)31-32;1-26(2,3)18-13-20(17-8-5-16(6-9-17)7-12-24(31)33-4)25(32)23(14-18)30-28-21-11-10-19(27)15-22(21)29-30;24-17-9-10-19-20(14-17)27-28(26-19)21-3-1-2-18(23(21)31)16-7-4-15(5-8-16)6-11-22(30)25-12-13-29;1-20(2,3)13-10-15(23-29-21(4,5)22(6,7)30-23)19(28)18(11-13)27-25-16-9-8-14(24)12-17(16)26-27;1-29-21(27)12-7-14-5-8-15(9-6-14)17-3-2-4-20(22(17)28)26-24-18-11-10-16(23)13-19(18)25-26;1-19(2,3)12-9-14(20(4,5)6)18(25)17(10-12)24-22-15-8-7-13(21)11-16(15)23-24;1-16(2,3)9-6-11(17)15(22)14(7-9)21-19-12-5-4-10(18)8-13(12)20-21;1-13-10(12)7-4-8-2-5-9(11)6-3-8;;;;;;/h6-7,9-12,16-18,38H,1,8,13-15H2,2-5H3,(H,33,37);3-7,9-12,16,34H,1,8,13-15H2,2H3,(H,29,33);4-5,7-10,14-16,33,35H,6,11-13H2,1-3H3,(H,29,34);5-6,8-11,13-15,32H,7,12H2,1-4H3;1-5,7-10,14,29,31H,6,11-13H2,(H,25,30);8-12,28H,1-7H3;2-6,8-11,13,28H,7,12H2,1H3;7-11,25H,1-6H3;4-8,22H,1-3H3;2-3,5-6H,4,7H2,1H3;1H4;2*1H;;1H;/q;;;;;;;;;;;;;+1;;-1
InChIKeyXAHROOPDDUWSHF-UHFFFAOYSA-N
MW4530.27 g/mol
LogP44.96
Rot. Bonds49

About potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide

potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide (PubChem CID 159728711) has the molecular formula C225H238BBrCl9FI2KN31O27 and a molecular weight of 4530.27 g/mol. Its IUPAC name is potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide.

Molecular Properties

Compound Namepotassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide
PubChem CID159728711
Molecular FormulaC225H238BBrCl9FI2KN31O27
Molecular Weight4530.27 g/mol
Exact Mass4522.24
IUPAC Namepotassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide
SMILESC.C=C(C)C(=O)OCCNC(=O)CCc1ccc(-c2cc(C(C)(C)C)cc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.C=C(C)C(=O)OCCNC(=O)CCc1ccc(-c2cccc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.CC(C)(C)c1cc(-c2ccc(CCC(=O)NCCO)cc2)c(O)c(-n2nc3ccc(Cl)cc3n2)c1.CC(C)(C)c1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(B2OC(C)(C)C(C)(C)O2)c(O)c(-n2nc3ccc(Cl)cc3n2)c1.CC(C)(C)c1cc(Br)c(O)c(-n2nc3ccc(Cl)cc3n2)c1.COC(=O)CCc1ccc(-c2cc(C(C)(C)C)cc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.COC(=O)CCc1ccc(-c2cccc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.COC(=O)CCc1ccc(I)cc1.F.I.O=C(CCc1ccc(-c2cccc(-n3nc4ccc(Cl)cc4n3)c2O)cc1)NCCO.[H-].[H][H].[K+]
InChIInChI=1S/C31H33ClN4O4.C27H25ClN4O4.C27H29ClN4O3.C26H26ClN3O3.C23H21ClN4O3.C22H27BClN3O3.C22H18ClN3O3.C20H24ClN3O.C16H15BrClN3O.C10H11IO2.CH4.FH.HI.K.H2.H/c1-19(2)30(39)40-15-14-33-28(37)13-8-20-6-9-21(10-7-20)24-16-22(31(3,4)5)17-27(29(24)38)36-34-25-12-11-23(32)18-26(25)35-36;1-17(2)27(35)36-15-14-29-25(33)13-8-18-6-9-19(10-7-18)21-4-3-5-24(26(21)34)32-30-22-12-11-20(28)16-23(22)31-32;1-27(2,3)19-14-21(18-7-4-17(5-8-18)6-11-25(34)29-12-13-33)26(35)24(15-19)32-30-22-10-9-20(28)16-23(22)31-32;1-26(2,3)18-13-20(17-8-5-16(6-9-17)7-12-24(31)33-4)25(32)23(14-18)30-28-21-11-10-19(27)15-22(21)29-30;24-17-9-10-19-20(14-17)27-28(26-19)21-3-1-2-18(23(21)31)16-7-4-15(5-8-16)6-11-22(30)25-12-13-29;1-20(2,3)13-10-15(23-29-21(4,5)22(6,7)30-23)19(28)18(11-13)27-25-16-9-8-14(24)12-17(16)26-27;1-29-21(27)12-7-14-5-8-15(9-6-14)17-3-2-4-20(22(17)28)26-24-18-11-10-16(23)13-19(18)25-26;1-19(2,3)12-9-14(20(4,5)6)18(25)17(10-12)24-22-15-8-7-13(21)11-16(15)23-24;1-16(2,3)9-6-11(17)15(22)14(7-9)21-19-12-5-4-10(18)8-13(12)20-21;1-13-10(12)7-4-8-2-5-9(11)6-3-8;;;;;;/h6-7,9-12,16-18,38H,1,8,13-15H2,2-5H3,(H,33,37);3-7,9-12,16,34H,1,8,13-15H2,2H3,(H,29,33);4-5,7-10,14-16,33,35H,6,11-13H2,1-3H3,(H,29,34);5-6,8-11,13-15,32H,7,12H2,1-4H3;1-5,7-10,14,29,31H,6,11-13H2,(H,25,30);8-12,28H,1-7H3;2-6,8-11,13,28H,7,12H2,1H3;7-11,25H,1-6H3;4-8,22H,1-3H3;2-3,5-6H,4,7H2,1H3;1H4;2*1H;;1H;/q;;;;;;;;;;;;;+1;;-1
InChIKeyXAHROOPDDUWSHF-UHFFFAOYSA-N
XLogP44.96
TPSA765.28 Ų
H-Bond Donors15
H-Bond Acceptors54
Rotatable Bonds49
Heavy Atoms298
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004530.27
LogP ≤ 544.96
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1054

Analyze potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide with MolForge

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Related Compounds

3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide
CID 137390704
3-[3-tert-butyl-5-(5-chlorobenzotriazol-2-yl)-4-hydroxyphenyl]-N-propylpropanamide
CID 23567676
3-[3-(5-chlorobenzotriazol-2-yl)-5-ethyl-4-hydroxyphenyl]propyl 2-methylprop-2-enoate
CID 59915533
4-(3-hydroxypropyl)-2-(2-phenylpropan-2-yl)-6-[5-(trifluoromethyl)benzotriazol-2-yl]phenol;methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate;methyl 3-[3-tert-butyl-4-hydroxy-5-[5-(trifluoromethyl)benzotriazol-2-yl]phenyl]propanoate;methyl 3-[3-(5-chlorobenzotriazol-2-yl)-4-hydroxy-5-(2-phenylpropan-2-yl)phenyl]propanoate
CID 158831969
CID 160893708
CID 160893708
3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-N-(3-hydroxypropyl)propanamide
CID 19871392
2-anthracen-9-yl-6-(5-chlorobenzotriazol-2-yl)-4-methylphenol;2-tert-butyl-6-(5-chlorobenzotriazol-2-yl)-4-methoxyphenol;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-phenylphenol;2-(5-chlorobenzotriazol-2-yl)-4-methyl-6-phenylphenol;2-(5-chlorobenzotriazol-2-yl)-4-methyl-6-(2-phenylphenyl)phenol
CID 158624938
2-[methoxy(dimethyl)silyl]ethyl 3-[3-tert-butyl-4-hydroxy-5-(5-phenylbenzotriazol-2-yl)phenyl]propanoate;sulfur dioxide
CID 160628911
3-[3-tert-butyl-5-(5-chlorobenzotriazol-2-yl)-4-hydroxyphenyl]-N-[1-(2-hydroxyethoxy)butan-2-yl]propanamide
CID 58604139
3-[3-(5-chlorobenzotriazol-2-yl)-5-[[3-(5-chlorobenzotriazol-2-yl)-2-hydroxy-5-[3-(2-methylprop-2-enoyloxy)propyl]phenyl]methyl]-4-hydroxyphenyl]propyl 2-methylprop-2-enoate
CID 18474460
2-[2-(5-chlorobenzotriazol-2-yl)phenyl]ethyl 2-methylprop-2-enoate
CID 174466915
methyl 2-[3-tert-butyl-5-(5-chlorobenzotriazol-2-yl)-4-hydroxyphenyl]propanoate
CID 130449214

Frequently Asked Questions

What is the IUPAC name of potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide?
The IUPAC name of potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide (CID 159728711) is potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide.
What is the SMILES notation for potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide?
The canonical SMILES for potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide is C.C=C(C)C(=O)OCCNC(=O)CCc1ccc(-c2cc(C(C)(C)C)cc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.C=C(C)C(=O)OCCNC(=O)CCc1ccc(-c2cccc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.CC(C)(C)c1cc(-c2ccc(CCC(=O)NCCO)cc2)c(O)c(-n2nc3ccc(Cl)cc3n2)c1.CC(C)(C)c1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(B2OC(C)(C)C(C)(C)O2)c(O)c(-n2nc3ccc(Cl)cc3n2)c1.CC(C)(C)c1cc(Br)c(O)c(-n2nc3ccc(Cl)cc3n2)c1.COC(=O)CCc1ccc(-c2cc(C(C)(C)C)cc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.COC(=O)CCc1ccc(-c2cccc(-n3nc4ccc(Cl)cc4n3)c2O)cc1.COC(=O)CCc1ccc(I)cc1.F.I.O=C(CCc1ccc(-c2cccc(-n3nc4ccc(Cl)cc4n3)c2O)cc1)NCCO.[H-].[H][H].[K+].
What is the InChIKey of potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide?
The InChIKey is XAHROOPDDUWSHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H33ClN4O4.C27H25ClN4O4.C27H29ClN4O3.C26H26ClN3O3.C23H21ClN4O3.C22H27BClN3O3.C22H18ClN3O3.C20H24ClN3O.C16H15BrClN3O.C10H11IO2.CH4.FH.HI.K.H2.H/c1-19(2)30(39)40-15-14-33-28(37)13-8-20-6-9-21(10-7-20)24-16-22(31(3,4)5)17-27(29(24)38)36-34-25-12-11-23(32)18-26(25)35-36;1-17(2)27(35)36-15-14-29-25(33)13-8-18-6-9-19(10-7-18)21-4-3-5-24(26(21)34)32-30-22-12-11-20(28)16-23(22)31-32;1-27(2,3)19-14-21(18-7-4-17(5-8-18)6-11-25(34)29-12-13-33)26(35)24(15-19)32-30-22-10-9-20(28)16-23(22)31-32;1-26(2,3)18-13-20(17-8-5-16(6-9-17)7-12-24(31)33-4)25(32)23(14-18)30-28-21-11-10-19(27)15-22(21)29-30;24-17-9-10-19-20(14-17)27-28(26-19)21-3-1-2-18(23(21)31)16-7-4-15(5-8-16)6-11-22(30)25-12-13-29;1-20(2,3)13-10-15(23-29-21(4,5)22(6,7)30-23)19(28)18(11-13)27-25-16-9-8-14(24)12-17(16)26-27;1-29-21(27)12-7-14-5-8-15(9-6-14)17-3-2-4-20(22(17)28)26-24-18-11-10-16(23)13-19(18)25-26;1-19(2,3)12-9-14(20(4,5)6)18(25)17(10-12)24-22-15-8-7-13(21)11-16(15)23-24;1-16(2,3)9-6-11(17)15(22)14(7-9)21-19-12-5-4-10(18)8-13(12)20-21;1-13-10(12)7-4-8-2-5-9(11)6-3-8;;;;;;/h6-7,9-12,16-18,38H,1,8,13-15H2,2-5H3,(H,33,37);3-7,9-12,16,34H,1,8,13-15H2,2H3,(H,29,33);4-5,7-10,14-16,33,35H,6,11-13H2,1-3H3,(H,29,34);5-6,8-11,13-15,32H,7,12H2,1-4H3;1-5,7-10,14,29,31H,6,11-13H2,(H,25,30);8-12,28H,1-7H3;2-6,8-11,13,28H,7,12H2,1H3;7-11,25H,1-6H3;4-8,22H,1-3H3;2-3,5-6H,4,7H2,1H3;1H4;2*1H;;1H;/q;;;;;;;;;;;;;+1;;-1.
What are the key properties of potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide?
potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide has a molecular weight of 4530.27 g/mol, XLogP of 44.96, 49 rotatable bonds, 15 hydrogen bond donors, and 54 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;2-bromo-4-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;4-tert-butyl-2-(5-chlorobenzotriazol-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol;3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]-N-(2-hydroxyethyl)propanamide;2-[3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoylamino]ethyl 2-methylprop-2-enoate;2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol;hydride;methane;methyl 3-[4-[5-tert-butyl-3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-[4-[3-(5-chlorobenzotriazol-2-yl)-2-hydroxyphenyl]phenyl]propanoate;methyl 3-(4-iodophenyl)propanoate;molecular hydrogen;hydrofluoride;hydroiodide is sourced from PubChem (CID 159728711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).