2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide

C146H143F4N33O17S9 — CID 159752280

IUPAC2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide
SMILESCC(C)(C)n1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.CC(c1ccccc1)n1c(SC(F)C(=O)Nc2ccccc2)nnc1-c1ccco1.CCCn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.CN(C)c1ccc(Cn2c(SCC(=O)Nc3ccccc3)nnc2-c2ccco2)cc1.COCCn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.CSCCn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.O=C(CSc1nnc(-c2ccco2)n1C(F)(F)F)Nc1ccccc1.O=C(CSc1nnc(-c2ccco2)n1C1CC1)Nc1ccccc1
InChIInChI=1S/C23H23N5O2S.C22H19FN4O2S.C18H20N4O2S.C17H18N4O3S.C17H18N4O2S2.C17H16N4O2S.C17H18N4O2S.C15H11F3N4O2S/c1-27(2)19-12-10-17(11-13-19)15-28-22(20-9-6-14-30-20)25-26-23(28)31-16-21(29)24-18-7-4-3-5-8-18;1-15(16-9-4-2-5-10-16)27-20(18-13-8-14-29-18)25-26-22(27)30-19(23)21(28)24-17-11-6-3-7-12-17;1-18(2,3)22-16(14-10-7-11-24-14)20-21-17(22)25-12-15(23)19-13-8-5-4-6-9-13;1-23-11-9-21-16(14-8-5-10-24-14)19-20-17(21)25-12-15(22)18-13-6-3-2-4-7-13;1-24-11-9-21-16(14-8-5-10-23-14)19-20-17(21)25-12-15(22)18-13-6-3-2-4-7-13;22-15(18-12-5-2-1-3-6-12)11-24-17-20-19-16(14-7-4-10-23-14)21(17)13-8-9-13;1-2-10-21-16(14-9-6-11-23-14)19-20-17(21)24-12-15(22)18-13-7-4-3-5-8-13;16-15(17,18)22-13(11-7-4-8-24-11)20-21-14(22)25-9-12(23)19-10-5-2-1-3-6-10/h3-14H,15-16H2,1-2H3,(H,24,29);2-15,19H,1H3,(H,24,28);4-11H,12H2,1-3H3,(H,19,23);2*2-8,10H,9,11-12H2,1H3,(H,18,22);1-7,10,13H,8-9,11H2,(H,18,22);3-9,11H,2,10,12H2,1H3,(H,18,22);1-8H,9H2,(H,19,23)
InChIKeyNDUKUJGXYISKJB-UHFFFAOYSA-N
MW2996.56 g/mol
LogP31.16
Rot. Bonds54

About 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide

2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide (PubChem CID 159752280) has the molecular formula C146H143F4N33O17S9 and a molecular weight of 2996.56 g/mol. Its IUPAC name is 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide
PubChem CID159752280
Molecular FormulaC146H143F4N33O17S9
Molecular Weight2996.56 g/mol
Exact Mass2993.88
IUPAC Name2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide
SMILESCC(C)(C)n1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.CC(c1ccccc1)n1c(SC(F)C(=O)Nc2ccccc2)nnc1-c1ccco1.CCCn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.CN(C)c1ccc(Cn2c(SCC(=O)Nc3ccccc3)nnc2-c2ccco2)cc1.COCCn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.CSCCn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.O=C(CSc1nnc(-c2ccco2)n1C(F)(F)F)Nc1ccccc1.O=C(CSc1nnc(-c2ccco2)n1C1CC1)Nc1ccccc1
InChIInChI=1S/C23H23N5O2S.C22H19FN4O2S.C18H20N4O2S.C17H18N4O3S.C17H18N4O2S2.C17H16N4O2S.C17H18N4O2S.C15H11F3N4O2S/c1-27(2)19-12-10-17(11-13-19)15-28-22(20-9-6-14-30-20)25-26-23(28)31-16-21(29)24-18-7-4-3-5-8-18;1-15(16-9-4-2-5-10-16)27-20(18-13-8-14-29-18)25-26-22(27)30-19(23)21(28)24-17-11-6-3-7-12-17;1-18(2,3)22-16(14-10-7-11-24-14)20-21-17(22)25-12-15(23)19-13-8-5-4-6-9-13;1-23-11-9-21-16(14-8-5-10-24-14)19-20-17(21)25-12-15(22)18-13-6-3-2-4-7-13;1-24-11-9-21-16(14-8-5-10-23-14)19-20-17(21)25-12-15(22)18-13-6-3-2-4-7-13;22-15(18-12-5-2-1-3-6-12)11-24-17-20-19-16(14-7-4-10-23-14)21(17)13-8-9-13;1-2-10-21-16(14-9-6-11-23-14)19-20-17(21)24-12-15(22)18-13-7-4-3-5-8-13;16-15(17,18)22-13(11-7-4-8-24-11)20-21-14(22)25-9-12(23)19-10-5-2-1-3-6-10/h3-14H,15-16H2,1-2H3,(H,24,29);2-15,19H,1H3,(H,24,28);4-11H,12H2,1-3H3,(H,19,23);2*2-8,10H,9,11-12H2,1H3,(H,18,22);1-7,10,13H,8-9,11H2,(H,18,22);3-9,11H,2,10,12H2,1H3,(H,18,22);1-8H,9H2,(H,19,23)
InChIKeyNDUKUJGXYISKJB-UHFFFAOYSA-N
XLogP31.16
TPSA596.07 Ų
H-Bond Donors8
H-Bond Acceptors51
Rotatable Bonds54
Heavy Atoms209
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002996.56
LogP ≤ 531.16
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1051

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide?
The IUPAC name of 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide (CID 159752280) is 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide.
What is the SMILES notation for 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide?
The canonical SMILES for 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide is CC(C)(C)n1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.CC(c1ccccc1)n1c(SC(F)C(=O)Nc2ccccc2)nnc1-c1ccco1.CCCn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.CN(C)c1ccc(Cn2c(SCC(=O)Nc3ccccc3)nnc2-c2ccco2)cc1.COCCn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.CSCCn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccco1.O=C(CSc1nnc(-c2ccco2)n1C(F)(F)F)Nc1ccccc1.O=C(CSc1nnc(-c2ccco2)n1C1CC1)Nc1ccccc1.
What is the InChIKey of 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide?
The InChIKey is NDUKUJGXYISKJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O2S.C22H19FN4O2S.C18H20N4O2S.C17H18N4O3S.C17H18N4O2S2.C17H16N4O2S.C17H18N4O2S.C15H11F3N4O2S/c1-27(2)19-12-10-17(11-13-19)15-28-22(20-9-6-14-30-20)25-26-23(28)31-16-21(29)24-18-7-4-3-5-8-18;1-15(16-9-4-2-5-10-16)27-20(18-13-8-14-29-18)25-26-22(27)30-19(23)21(28)24-17-11-6-3-7-12-17;1-18(2,3)22-16(14-10-7-11-24-14)20-21-17(22)25-12-15(23)19-13-8-5-4-6-9-13;1-23-11-9-21-16(14-8-5-10-24-14)19-20-17(21)25-12-15(22)18-13-6-3-2-4-7-13;1-24-11-9-21-16(14-8-5-10-23-14)19-20-17(21)25-12-15(22)18-13-6-3-2-4-7-13;22-15(18-12-5-2-1-3-6-12)11-24-17-20-19-16(14-7-4-10-23-14)21(17)13-8-9-13;1-2-10-21-16(14-9-6-11-23-14)19-20-17(21)24-12-15(22)18-13-7-4-3-5-8-13;16-15(17,18)22-13(11-7-4-8-24-11)20-21-14(22)25-9-12(23)19-10-5-2-1-3-6-10/h3-14H,15-16H2,1-2H3,(H,24,29);2-15,19H,1H3,(H,24,28);4-11H,12H2,1-3H3,(H,19,23);2*2-8,10H,9,11-12H2,1H3,(H,18,22);1-7,10,13H,8-9,11H2,(H,18,22);3-9,11H,2,10,12H2,1H3,(H,18,22);1-8H,9H2,(H,19,23).
What are the key properties of 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide?
2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide has a molecular weight of 2996.56 g/mol, XLogP of 31.16, 54 rotatable bonds, 8 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-tert-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-fluoro-2-[[5-(furan-2-yl)-4-(1-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(2-methylsulfanylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[5-(furan-2-yl)-4-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide is sourced from PubChem (CID 159752280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).