4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen

C161H161F7N10O30S2 — CID 157103159

IUPAC4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen
SMILESCN(C)S(=O)(=O)c1ccc(-c2ccc(F)c(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)c2)cc1.COc1cc(-c2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)ccc2C)c2c(c1OC)C(=O)CC2.Cc1cc(NC(=O)CO)ccc1-c1cc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)ccc1C.Cc1ccc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)cc1-c1ccc(C(=O)N[C@@H](CO)CC(C)C)cc1.Cc1ccccc1-c1cc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)ccc1OC(F)(F)F.NS(=O)(=O)c1ccc(-c2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)cc(C(F)(F)F)c2)cc1.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C31H34N2O5.C29H27NO6.C27H26N2O5.C25H20F3NO4.C25H23FN2O5S.C24H19F3N2O5S.6H2/c1-19(2)14-25(17-34)32-29(35)22-7-5-21(6-8-22)26-16-24(10-4-20(26)3)33-30(36)31(12-13-31)23-9-11-27-28(15-23)38-18-37-27;1-16-4-6-18(30-28(32)29(10-11-29)17-5-9-23-24(12-17)36-15-35-23)13-20(16)21-14-25(33-2)27(34-3)26-19(21)7-8-22(26)31;1-16-3-5-20(13-22(16)21-7-6-19(11-17(21)2)28-25(31)14-30)29-26(32)27(9-10-27)18-4-8-23-24(12-18)34-15-33-23;1-15-4-2-3-5-18(15)19-13-17(7-9-20(19)33-25(26,27)28)29-23(30)24(10-11-24)16-6-8-21-22(12-16)32-14-31-21;1-28(2)34(30,31)19-7-3-16(4-8-19)17-5-9-20(26)21(13-17)27-24(29)25(11-12-25)18-6-10-22-23(14-18)33-15-32-22;25-24(26,27)17-9-15(14-1-4-19(5-2-14)35(28,31)32)10-18(11-17)29-22(30)23(7-8-23)16-3-6-20-21(12-16)34-13-33-20;;;;;;/h4-11,15-16,19,25,34H,12-14,17-18H2,1-3H3,(H,32,35)(H,33,36);4-6,9,12-14H,7-8,10-11,15H2,1-3H3,(H,30,32);3-8,11-13,30H,9-10,14-15H2,1-2H3,(H,28,31)(H,29,32);2-9,12-13H,10-11,14H2,1H3,(H,29,30);3-10,13-14H,11-12,15H2,1-2H3,(H,27,29);1-6,9-12H,7-8,13H2,(H,29,30)(H2,28,31,32);6*1H/t25-;;;;;;;;;;;/m1.........../s1
InChIKeyAFZQCUSOGASRTJ-MLCVMZTOSA-N
MW2913.22 g/mol
LogP30.70
Rot. Bonds37

About 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen

4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen (PubChem CID 157103159) has the molecular formula C161H161F7N10O30S2 and a molecular weight of 2913.22 g/mol. Its IUPAC name is 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen.

Molecular Properties

Compound Name4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen
PubChem CID157103159
Molecular FormulaC161H161F7N10O30S2
Molecular Weight2913.22 g/mol
Exact Mass2911.07
IUPAC Name4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen
SMILESCN(C)S(=O)(=O)c1ccc(-c2ccc(F)c(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)c2)cc1.COc1cc(-c2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)ccc2C)c2c(c1OC)C(=O)CC2.Cc1cc(NC(=O)CO)ccc1-c1cc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)ccc1C.Cc1ccc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)cc1-c1ccc(C(=O)N[C@@H](CO)CC(C)C)cc1.Cc1ccccc1-c1cc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)ccc1OC(F)(F)F.NS(=O)(=O)c1ccc(-c2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)cc(C(F)(F)F)c2)cc1.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C31H34N2O5.C29H27NO6.C27H26N2O5.C25H20F3NO4.C25H23FN2O5S.C24H19F3N2O5S.6H2/c1-19(2)14-25(17-34)32-29(35)22-7-5-21(6-8-22)26-16-24(10-4-20(26)3)33-30(36)31(12-13-31)23-9-11-27-28(15-23)38-18-37-27;1-16-4-6-18(30-28(32)29(10-11-29)17-5-9-23-24(12-17)36-15-35-23)13-20(16)21-14-25(33-2)27(34-3)26-19(21)7-8-22(26)31;1-16-3-5-20(13-22(16)21-7-6-19(11-17(21)2)28-25(31)14-30)29-26(32)27(9-10-27)18-4-8-23-24(12-18)34-15-33-23;1-15-4-2-3-5-18(15)19-13-17(7-9-20(19)33-25(26,27)28)29-23(30)24(10-11-24)16-6-8-21-22(12-16)32-14-31-21;1-28(2)34(30,31)19-7-3-16(4-8-19)17-5-9-20(26)21(13-17)27-24(29)25(11-12-25)18-6-10-22-23(14-18)33-15-32-22;25-24(26,27)17-9-15(14-1-4-19(5-2-14)35(28,31)32)10-18(11-17)29-22(30)23(7-8-23)16-3-6-20-21(12-16)34-13-33-20;;;;;;/h4-11,15-16,19,25,34H,12-14,17-18H2,1-3H3,(H,32,35)(H,33,36);4-6,9,12-14H,7-8,10-11,15H2,1-3H3,(H,30,32);3-8,11-13,30H,9-10,14-15H2,1-2H3,(H,28,31)(H,29,32);2-9,12-13H,10-11,14H2,1H3,(H,29,30);3-10,13-14H,11-12,15H2,1-2H3,(H,27,29);1-6,9-12H,7-8,13H2,(H,29,30)(H2,28,31,32);6*1H/t25-;;;;;;;;;;;/m1.........../s1
InChIKeyAFZQCUSOGASRTJ-MLCVMZTOSA-N
XLogP30.70
TPSA526.32 Ų
H-Bond Donors11
H-Bond Acceptors30
Rotatable Bonds37
Heavy Atoms210
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002913.22
LogP ≤ 530.70
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1030

Analyze 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen?
The IUPAC name of 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen (CID 157103159) is 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen.
What is the SMILES notation for 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen?
The canonical SMILES for 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen is CN(C)S(=O)(=O)c1ccc(-c2ccc(F)c(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)c2)cc1.COc1cc(-c2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)ccc2C)c2c(c1OC)C(=O)CC2.Cc1cc(NC(=O)CO)ccc1-c1cc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)ccc1C.Cc1ccc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)cc1-c1ccc(C(=O)N[C@@H](CO)CC(C)C)cc1.Cc1ccccc1-c1cc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)ccc1OC(F)(F)F.NS(=O)(=O)c1ccc(-c2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)cc(C(F)(F)F)c2)cc1.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].
What is the InChIKey of 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen?
The InChIKey is AFZQCUSOGASRTJ-MLCVMZTOSA-N. The full InChI is InChI=1S/C31H34N2O5.C29H27NO6.C27H26N2O5.C25H20F3NO4.C25H23FN2O5S.C24H19F3N2O5S.6H2/c1-19(2)14-25(17-34)32-29(35)22-7-5-21(6-8-22)26-16-24(10-4-20(26)3)33-30(36)31(12-13-31)23-9-11-27-28(15-23)38-18-37-27;1-16-4-6-18(30-28(32)29(10-11-29)17-5-9-23-24(12-17)36-15-35-23)13-20(16)21-14-25(33-2)27(34-3)26-19(21)7-8-22(26)31;1-16-3-5-20(13-22(16)21-7-6-19(11-17(21)2)28-25(31)14-30)29-26(32)27(9-10-27)18-4-8-23-24(12-18)34-15-33-23;1-15-4-2-3-5-18(15)19-13-17(7-9-20(19)33-25(26,27)28)29-23(30)24(10-11-24)16-6-8-21-22(12-16)32-14-31-21;1-28(2)34(30,31)19-7-3-16(4-8-19)17-5-9-20(26)21(13-17)27-24(29)25(11-12-25)18-6-10-22-23(14-18)33-15-32-22;25-24(26,27)17-9-15(14-1-4-19(5-2-14)35(28,31)32)10-18(11-17)29-22(30)23(7-8-23)16-3-6-20-21(12-16)34-13-33-20;;;;;;/h4-11,15-16,19,25,34H,12-14,17-18H2,1-3H3,(H,32,35)(H,33,36);4-6,9,12-14H,7-8,10-11,15H2,1-3H3,(H,30,32);3-8,11-13,30H,9-10,14-15H2,1-2H3,(H,28,31)(H,29,32);2-9,12-13H,10-11,14H2,1H3,(H,29,30);3-10,13-14H,11-12,15H2,1-2H3,(H,27,29);1-6,9-12H,7-8,13H2,(H,29,30)(H2,28,31,32);6*1H/t25-;;;;;;;;;;;/m1.........../s1.
What are the key properties of 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen?
4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen has a molecular weight of 2913.22 g/mol, XLogP of 30.70, 37 rotatable bonds, 11 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-methylphenyl]-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide;1-(1,3-benzodioxol-5-yl)-N-[3-(6,7-dimethoxy-1-oxo-2,3-dihydroinden-4-yl)-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[5-[4-(dimethylsulfamoyl)phenyl]-2-fluorophenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-[4-[(2-hydroxyacetyl)amino]-2-methylphenyl]-4-methylphenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(2-methylphenyl)-4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[3-(4-sulfamoylphenyl)-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;molecular hydrogen is sourced from PubChem (CID 157103159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).