2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide

C134H133Br2F12N23O24S — CID 159400405

IUPAC2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide
SMILESBr.BrCc1ccccn1.CC(O)CCn1c(=O)c2c(nc(Cc3cccc(OC(F)(F)F)c3)n2Cc2ccccn2)n(C)c1=O.COc1ccc(Cn2c(=O)c(N)c(N)n(C)c2=O)cc1.COc1ccc(Cn2c(=O)c3c(n(C)c2=O)N=C(Cc2cccc(OC(F)(F)F)c2)C3)cc1.COc1ccc(Cn2c(=O)c3c(nc(Cc4cccc(OC(F)(F)F)c4)n3Cc3ccccn3)n(C)c2=O)cc1.Cc1ccc(S(=O)(=O)OCCC(C)O)cc1.Cc1cccc(CC(=O)O)c1.Cn1c(=O)[nH]c(=O)c2c1nc(Cc1cccc(OC(F)(F)F)c1)n2Cc1ccccn1
InChIInChI=1S/C28H24F3N5O4.C24H24F3N5O4.C23H20F3N3O4.C20H16F3N5O3.C13H16N4O3.C11H16O4S.C9H10O2.C6H6BrN.BrH/c1-34-25-24(26(37)36(27(34)38)16-18-9-11-21(39-2)12-10-18)35(17-20-7-3-4-13-32-20)23(33-25)15-19-6-5-8-22(14-19)40-28(29,30)31;1-15(33)9-11-31-22(34)20-21(30(2)23(31)35)29-19(32(20)14-17-7-3-4-10-28-17)13-16-6-5-8-18(12-16)36-24(25,26)27;1-28-20-19(21(30)29(22(28)31)13-14-6-8-17(32-2)9-7-14)12-16(27-20)10-15-4-3-5-18(11-15)33-23(24,25)26;1-27-17-16(18(29)26-19(27)30)28(11-13-6-2-3-8-24-13)15(25-17)10-12-5-4-7-14(9-12)31-20(21,22)23;1-16-11(15)10(14)12(18)17(13(16)19)7-8-3-5-9(20-2)6-4-8;1-9-3-5-11(6-4-9)16(13,14)15-8-7-10(2)12;1-7-3-2-4-8(5-7)6-9(10)11;7-5-6-3-1-2-4-8-6;/h3-14H,15-17H2,1-2H3;3-8,10,12,15,33H,9,11,13-14H2,1-2H3;3-9,11H,10,12-13H2,1-2H3;2-9H,10-11H2,1H3,(H,26,29,30);3-6H,7,14-15H2,1-2H3;3-6,10,12H,7-8H2,1-2H3;2-5H,6H2,1H3,(H,10,11);1-4H,5H2;1H
InChIKeyCSJRDJGWGIJDMH-UHFFFAOYSA-N
MW2869.53 g/mol
LogP17.63
Rot. Bonds38

About 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide

2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide (PubChem CID 159400405) has the molecular formula C134H133Br2F12N23O24S and a molecular weight of 2869.53 g/mol. Its IUPAC name is 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide.

Molecular Properties

Compound Name2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide
PubChem CID159400405
Molecular FormulaC134H133Br2F12N23O24S
Molecular Weight2869.53 g/mol
Exact Mass2865.78
IUPAC Name2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide
SMILESBr.BrCc1ccccn1.CC(O)CCn1c(=O)c2c(nc(Cc3cccc(OC(F)(F)F)c3)n2Cc2ccccn2)n(C)c1=O.COc1ccc(Cn2c(=O)c(N)c(N)n(C)c2=O)cc1.COc1ccc(Cn2c(=O)c3c(n(C)c2=O)N=C(Cc2cccc(OC(F)(F)F)c2)C3)cc1.COc1ccc(Cn2c(=O)c3c(nc(Cc4cccc(OC(F)(F)F)c4)n3Cc3ccccn3)n(C)c2=O)cc1.Cc1ccc(S(=O)(=O)OCCC(C)O)cc1.Cc1cccc(CC(=O)O)c1.Cn1c(=O)[nH]c(=O)c2c1nc(Cc1cccc(OC(F)(F)F)c1)n2Cc1ccccn1
InChIInChI=1S/C28H24F3N5O4.C24H24F3N5O4.C23H20F3N3O4.C20H16F3N5O3.C13H16N4O3.C11H16O4S.C9H10O2.C6H6BrN.BrH/c1-34-25-24(26(37)36(27(34)38)16-18-9-11-21(39-2)12-10-18)35(17-20-7-3-4-13-32-20)23(33-25)15-19-6-5-8-22(14-19)40-28(29,30)31;1-15(33)9-11-31-22(34)20-21(30(2)23(31)35)29-19(32(20)14-17-7-3-4-10-28-17)13-16-6-5-8-18(12-16)36-24(25,26)27;1-28-20-19(21(30)29(22(28)31)13-14-6-8-17(32-2)9-7-14)12-16(27-20)10-15-4-3-5-18(11-15)33-23(24,25)26;1-27-17-16(18(29)26-19(27)30)28(11-13-6-2-3-8-24-13)15(25-17)10-12-5-4-7-14(9-12)31-20(21,22)23;1-16-11(15)10(14)12(18)17(13(16)19)7-8-3-5-9(20-2)6-4-8;1-9-3-5-11(6-4-9)16(13,14)15-8-7-10(2)12;1-7-3-2-4-8(5-7)6-9(10)11;7-5-6-3-1-2-4-8-6;/h3-14H,15-17H2,1-2H3;3-8,10,12,15,33H,9,11,13-14H2,1-2H3;3-9,11H,10,12-13H2,1-2H3;2-9H,10-11H2,1H3,(H,26,29,30);3-6H,7,14-15H2,1-2H3;3-6,10,12H,7-8H2,1-2H3;2-5H,6H2,1H3,(H,10,11);1-4H,5H2;1H
InChIKeyCSJRDJGWGIJDMH-UHFFFAOYSA-N
XLogP17.63
TPSA586.02 Ų
H-Bond Donors6
H-Bond Acceptors45
Rotatable Bonds38
Heavy Atoms196
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002869.53
LogP ≤ 517.63
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1045

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_1', 'substructure': 'N/A'}

Analyze 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide with MolForge

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Related Compounds

3-Hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione
CID 158277730
sodium;tert-butyl N-(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)carbamate;3,8-dimethylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)-[[4-(trifluoromethoxy)phenyl]methyl]sulfamoyl]benzoate;methyl 4-[(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]benzoate;methyl 4-[(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)sulfamoyl]benzoate;methyl 4-[(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)-[[4-(trifluoromethoxy)phenyl]methyl]sulfamoyl]benzoate
CID 158315296
sodium;tert-butyl N-(3-methylimidazo[1,2-a]pyridin-2-yl)carbamate;ethyl 3-bromo-2-oxobutanoate;ethyl 3-methylimidazo[1,2-a]pyridine-2-carboxylate;ethyl 2-oxobutanoate;3-methylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[(3-methylimidazo[1,2-a]pyridin-2-yl)-[[4-(trifluoromethoxy)phenyl]methyl]sulfamoyl]benzoate;methyl 4-[(3-methylimidazo[1,2-a]pyridin-2-yl)-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]benzoate;methyl 4-[(3-methylimidazo[1,2-a]pyridin-2-yl)sulfamoyl]benzoate;methyl 4-[(3-methylimidazo[1,2-a]pyridin-2-yl)-[[4-(trifluoromethoxy)phenyl]methyl]sulfamoyl]benzoate
CID 159822768
sodium;tert-butyl N-(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)carbamate;3,8-dimethylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)-[[4-(trifluoromethoxy)phenyl]methyl]sulfamoyl]benzoate;ethane;methyl 4-[(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]benzoate;methyl 4-[(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)sulfamoyl]benzoate;methyl 4-[(3,8-dimethylimidazo[1,2-a]pyridin-2-yl)-[[4-(trifluoromethoxy)phenyl]methyl]sulfamoyl]benzoate;propane
CID 161576852

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide?
The IUPAC name of 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide (CID 159400405) is 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide.
What is the SMILES notation for 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide?
The canonical SMILES for 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide is Br.BrCc1ccccn1.CC(O)CCn1c(=O)c2c(nc(Cc3cccc(OC(F)(F)F)c3)n2Cc2ccccn2)n(C)c1=O.COc1ccc(Cn2c(=O)c(N)c(N)n(C)c2=O)cc1.COc1ccc(Cn2c(=O)c3c(n(C)c2=O)N=C(Cc2cccc(OC(F)(F)F)c2)C3)cc1.COc1ccc(Cn2c(=O)c3c(nc(Cc4cccc(OC(F)(F)F)c4)n3Cc3ccccn3)n(C)c2=O)cc1.Cc1ccc(S(=O)(=O)OCCC(C)O)cc1.Cc1cccc(CC(=O)O)c1.Cn1c(=O)[nH]c(=O)c2c1nc(Cc1cccc(OC(F)(F)F)c1)n2Cc1ccccn1.
What is the InChIKey of 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide?
The InChIKey is CSJRDJGWGIJDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24F3N5O4.C24H24F3N5O4.C23H20F3N3O4.C20H16F3N5O3.C13H16N4O3.C11H16O4S.C9H10O2.C6H6BrN.BrH/c1-34-25-24(26(37)36(27(34)38)16-18-9-11-21(39-2)12-10-18)35(17-20-7-3-4-13-32-20)23(33-25)15-19-6-5-8-22(14-19)40-28(29,30)31;1-15(33)9-11-31-22(34)20-21(30(2)23(31)35)29-19(32(20)14-17-7-3-4-10-28-17)13-16-6-5-8-18(12-16)36-24(25,26)27;1-28-20-19(21(30)29(22(28)31)13-14-6-8-17(32-2)9-7-14)12-16(27-20)10-15-4-3-5-18(11-15)33-23(24,25)26;1-27-17-16(18(29)26-19(27)30)28(11-13-6-2-3-8-24-13)15(25-17)10-12-5-4-7-14(9-12)31-20(21,22)23;1-16-11(15)10(14)12(18)17(13(16)19)7-8-3-5-9(20-2)6-4-8;1-9-3-5-11(6-4-9)16(13,14)15-8-7-10(2)12;1-7-3-2-4-8(5-7)6-9(10)11;7-5-6-3-1-2-4-8-6;/h3-14H,15-17H2,1-2H3;3-8,10,12,15,33H,9,11,13-14H2,1-2H3;3-9,11H,10,12-13H2,1-2H3;2-9H,10-11H2,1H3,(H,26,29,30);3-6H,7,14-15H2,1-2H3;3-6,10,12H,7-8H2,1-2H3;2-5H,6H2,1H3,(H,10,11);1-4H,5H2;1H.
What are the key properties of 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide?
2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide has a molecular weight of 2869.53 g/mol, XLogP of 17.63, 38 rotatable bonds, 6 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)pyridine;5,6-diamino-3-[(4-methoxyphenyl)methyl]-1-methylpyrimidine-2,4-dione;3-hydroxybutyl 4-methylbenzenesulfonate;1-(3-hydroxybutyl)-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;1-[(4-methoxyphenyl)methyl]-3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;3-[(4-methoxyphenyl)methyl]-1-methyl-6-[[3-(trifluoromethoxy)phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione;2-(3-methylphenyl)acetic acid;3-methyl-7-(pyridin-2-ylmethyl)-8-[[3-(trifluoromethoxy)phenyl]methyl]purine-2,6-dione;hydrobromide is sourced from PubChem (CID 159400405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).