N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide

C185H211F4N31O35S15 — CID 160707881

IUPACN-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide
SMILESCC(C)(C)S(=O)(=O)Nc1ccc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc3scnc3c2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2cccc3nsnc23)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ncccn2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ncncn2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2nnc(-c3ccc(F)cc3)s2)cc1.COc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)(C)C)cc2)cc(OC)c1OC.Cc1cc(C(F)(F)F)ccc1NC(=O)c1ccc(NS(=O)(=O)C(C)(C)C)cc1.Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)(C)C)cc2)cc2ccsc12.Cc1ccc(-c2ccc(NC(=O)c3ccc(NS(=O)(=O)C(C)(C)C)cc3)cc2)cc1
InChIInChI=1S/C24H26N2O3S.C20H26N2O6S.C20H22N2O3S2.C19H21F3N2O3S.C19H19FN4O3S2.C19H25N3O5S2.C18H19N3O3S2.C17H18N4O3S2.C15H18N4O3S.C14H17N5O3S/c1-17-5-7-18(8-6-17)19-9-13-21(14-10-19)25-23(27)20-11-15-22(16-12-20)26-30(28,29)24(2,3)4;1-20(2,3)29(24,25)22-14-9-7-13(8-10-14)19(23)21-15-11-16(26-4)18(28-6)17(12-15)27-5;1-13-11-17(12-15-9-10-26-18(13)15)21-19(23)14-5-7-16(8-6-14)22-27(24,25)20(2,3)4;1-12-11-14(19(20,21)22)7-10-16(12)23-17(25)13-5-8-15(9-6-13)24-28(26,27)18(2,3)4;1-19(2,3)29(26,27)24-15-10-6-12(7-11-15)16(25)21-18-23-22-17(28-18)13-4-8-14(20)9-5-13;1-19(2,3)29(26,27)22-16-8-6-15(7-9-16)18(23)21-13-12-14-4-10-17(11-5-14)28(20,24)25;1-18(2,3)26(23,24)21-13-6-4-12(5-7-13)17(22)20-14-8-9-16-15(10-14)19-11-25-16;1-17(2,3)26(23,24)21-12-9-7-11(8-10-12)16(22)18-13-5-4-6-14-15(13)20-25-19-14;1-15(2,3)23(21,22)19-12-7-5-11(6-8-12)13(20)18-14-16-9-4-10-17-14;1-14(2,3)23(21,22)19-11-6-4-10(5-7-11)12(20)18-13-16-8-15-9-17-13/h5-16,26H,1-4H3,(H,25,27);7-12,22H,1-6H3,(H,21,23);5-12,22H,1-4H3,(H,21,23);5-11,24H,1-4H3,(H,23,25);4-11,24H,1-3H3,(H,21,23,25);4-11,22H,12-13H2,1-3H3,(H,21,23)(H2,20,24,25);4-11,21H,1-3H3,(H,20,22);4-10,21H,1-3H3,(H,18,22);4-10,19H,1-3H3,(H,16,17,18,20);4-9,19H,1-3H3,(H,15,16,17,18,20)
InChIKeyRRLURYJTEMXMND-UHFFFAOYSA-N
MW3985.90 g/mol
LogP36.26
Rot. Bonds48

About N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide

N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide (PubChem CID 160707881) has the molecular formula C185H211F4N31O35S15 and a molecular weight of 3985.90 g/mol. Its IUPAC name is N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide.

Molecular Properties

Compound NameN-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide
PubChem CID160707881
Molecular FormulaC185H211F4N31O35S15
Molecular Weight3985.90 g/mol
Exact Mass3982.14
IUPAC NameN-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide
SMILESCC(C)(C)S(=O)(=O)Nc1ccc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc3scnc3c2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2cccc3nsnc23)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ncccn2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ncncn2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2nnc(-c3ccc(F)cc3)s2)cc1.COc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)(C)C)cc2)cc(OC)c1OC.Cc1cc(C(F)(F)F)ccc1NC(=O)c1ccc(NS(=O)(=O)C(C)(C)C)cc1.Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)(C)C)cc2)cc2ccsc12.Cc1ccc(-c2ccc(NC(=O)c3ccc(NS(=O)(=O)C(C)(C)C)cc3)cc2)cc1
InChIInChI=1S/C24H26N2O3S.C20H26N2O6S.C20H22N2O3S2.C19H21F3N2O3S.C19H19FN4O3S2.C19H25N3O5S2.C18H19N3O3S2.C17H18N4O3S2.C15H18N4O3S.C14H17N5O3S/c1-17-5-7-18(8-6-17)19-9-13-21(14-10-19)25-23(27)20-11-15-22(16-12-20)26-30(28,29)24(2,3)4;1-20(2,3)29(24,25)22-14-9-7-13(8-10-14)19(23)21-15-11-16(26-4)18(28-6)17(12-15)27-5;1-13-11-17(12-15-9-10-26-18(13)15)21-19(23)14-5-7-16(8-6-14)22-27(24,25)20(2,3)4;1-12-11-14(19(20,21)22)7-10-16(12)23-17(25)13-5-8-15(9-6-13)24-28(26,27)18(2,3)4;1-19(2,3)29(26,27)24-15-10-6-12(7-11-15)16(25)21-18-23-22-17(28-18)13-4-8-14(20)9-5-13;1-19(2,3)29(26,27)22-16-8-6-15(7-9-16)18(23)21-13-12-14-4-10-17(11-5-14)28(20,24)25;1-18(2,3)26(23,24)21-13-6-4-12(5-7-13)17(22)20-14-8-9-16-15(10-14)19-11-25-16;1-17(2,3)26(23,24)21-12-9-7-11(8-10-12)16(22)18-13-5-4-6-14-15(13)20-25-19-14;1-15(2,3)23(21,22)19-12-7-5-11(6-8-12)13(20)18-14-16-9-4-10-17-14;1-14(2,3)23(21,22)19-11-6-4-10(5-7-11)12(20)18-13-16-8-15-9-17-13/h5-16,26H,1-4H3,(H,25,27);7-12,22H,1-6H3,(H,21,23);5-12,22H,1-4H3,(H,21,23);5-11,24H,1-4H3,(H,23,25);4-11,24H,1-3H3,(H,21,23,25);4-11,22H,12-13H2,1-3H3,(H,21,23)(H2,20,24,25);4-11,21H,1-3H3,(H,20,22);4-10,21H,1-3H3,(H,18,22);4-10,19H,1-3H3,(H,16,17,18,20);4-9,19H,1-3H3,(H,15,16,17,18,20)
InChIKeyRRLURYJTEMXMND-UHFFFAOYSA-N
XLogP36.26
TPSA969.45 Ų
H-Bond Donors21
H-Bond Acceptors49
Rotatable Bonds48
Heavy Atoms270
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003985.90
LogP ≤ 536.26
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1049

Analyze N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide?
The IUPAC name of N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide (CID 160707881) is N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide.
What is the SMILES notation for N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide?
The canonical SMILES for N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide is CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc3scnc3c2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2cccc3nsnc23)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ncccn2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ncncn2)cc1.CC(C)(C)S(=O)(=O)Nc1ccc(C(=O)Nc2nnc(-c3ccc(F)cc3)s2)cc1.COc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)(C)C)cc2)cc(OC)c1OC.Cc1cc(C(F)(F)F)ccc1NC(=O)c1ccc(NS(=O)(=O)C(C)(C)C)cc1.Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)(C)C)cc2)cc2ccsc12.Cc1ccc(-c2ccc(NC(=O)c3ccc(NS(=O)(=O)C(C)(C)C)cc3)cc2)cc1.
What is the InChIKey of N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide?
The InChIKey is RRLURYJTEMXMND-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3S.C20H26N2O6S.C20H22N2O3S2.C19H21F3N2O3S.C19H19FN4O3S2.C19H25N3O5S2.C18H19N3O3S2.C17H18N4O3S2.C15H18N4O3S.C14H17N5O3S/c1-17-5-7-18(8-6-17)19-9-13-21(14-10-19)25-23(27)20-11-15-22(16-12-20)26-30(28,29)24(2,3)4;1-20(2,3)29(24,25)22-14-9-7-13(8-10-14)19(23)21-15-11-16(26-4)18(28-6)17(12-15)27-5;1-13-11-17(12-15-9-10-26-18(13)15)21-19(23)14-5-7-16(8-6-14)22-27(24,25)20(2,3)4;1-12-11-14(19(20,21)22)7-10-16(12)23-17(25)13-5-8-15(9-6-13)24-28(26,27)18(2,3)4;1-19(2,3)29(26,27)24-15-10-6-12(7-11-15)16(25)21-18-23-22-17(28-18)13-4-8-14(20)9-5-13;1-19(2,3)29(26,27)22-16-8-6-15(7-9-16)18(23)21-13-12-14-4-10-17(11-5-14)28(20,24)25;1-18(2,3)26(23,24)21-13-6-4-12(5-7-13)17(22)20-14-8-9-16-15(10-14)19-11-25-16;1-17(2,3)26(23,24)21-12-9-7-11(8-10-12)16(22)18-13-5-4-6-14-15(13)20-25-19-14;1-15(2,3)23(21,22)19-12-7-5-11(6-8-12)13(20)18-14-16-9-4-10-17-14;1-14(2,3)23(21,22)19-11-6-4-10(5-7-11)12(20)18-13-16-8-15-9-17-13/h5-16,26H,1-4H3,(H,25,27);7-12,22H,1-6H3,(H,21,23);5-12,22H,1-4H3,(H,21,23);5-11,24H,1-4H3,(H,23,25);4-11,24H,1-3H3,(H,21,23,25);4-11,22H,12-13H2,1-3H3,(H,21,23)(H2,20,24,25);4-11,21H,1-3H3,(H,20,22);4-10,21H,1-3H3,(H,18,22);4-10,19H,1-3H3,(H,16,17,18,20);4-9,19H,1-3H3,(H,15,16,17,18,20).
What are the key properties of N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide?
N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide has a molecular weight of 3985.90 g/mol, XLogP of 36.26, 48 rotatable bonds, 21 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,1,3-benzothiadiazol-4-yl)-4-(tert-butylsulfonylamino)benzamide;N-(1,3-benzothiazol-5-yl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]benzamide;4-(tert-butylsulfonylamino)-N-(7-methyl-1-benzothiophen-5-yl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(4-methylphenyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]benzamide;4-(tert-butylsulfonylamino)-N-pyrimidin-2-ylbenzamide;4-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide;4-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)benzamide;4-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)benzamide is sourced from PubChem (CID 160707881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).