N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide

C212H202Cl5F8N67O13S14 — CID 159934254

IUPACN-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide
SMILESCCc1nc(Nc2ncc(CC(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(C)CC2)n1.CCc1nc(Nc2ncc(CC(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(CCO)CC2)n1.CN1CCN(c2ncnc(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)n2)CC1.Cc1ccc(Sc2nc(C)nc(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)n2)cc1.Cc1cccc(Sc2nc(C)nc(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)n2)c1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Oc2ccc(Cl)c(Cl)c2)n1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Oc2ccc(Cl)cc2)n1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Sc2ccccc2)n1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Sc2ccccc2C)n1.O=C(Cc1cnc(Nc2ncnc(N3CCCCC3)n2)s1)Nc1cccc(F)c1
InChIInChI=1S/C23H29ClN8O2S.C22H27ClN8OS.3C22H19FN6OS2.C21H15Cl2FN6O2S.C21H16ClFN6O2S.C21H17FN6OS2.C19H21FN8OS.C19H20FN7OS/c1-3-18-26-21(29-22(27-18)32-9-7-31(8-10-32)11-12-33)30-23-25-14-16(35-23)13-19(34)28-20-15(2)5-4-6-17(20)24;1-4-17-25-20(28-21(26-17)31-10-8-30(3)9-11-31)29-22-24-13-15(33-22)12-18(32)27-19-14(2)6-5-7-16(19)23;1-13-5-3-8-17(9-13)31-22-26-14(2)25-20(29-22)28-21-24-12-18(32-21)11-19(30)27-16-7-4-6-15(23)10-16;1-13-6-3-4-9-18(13)32-22-26-14(2)25-20(29-22)28-21-24-12-17(31-21)11-19(30)27-16-8-5-7-15(23)10-16;1-13-6-8-17(9-7-13)31-22-26-14(2)25-20(29-22)28-21-24-12-18(32-21)11-19(30)27-16-5-3-4-15(23)10-16;1-11-26-19(29-20(27-11)32-14-5-6-16(22)17(23)8-14)30-21-25-10-15(33-21)9-18(31)28-13-4-2-3-12(24)7-13;1-12-25-19(28-20(26-12)31-16-7-5-13(22)6-8-16)29-21-24-11-17(32-21)10-18(30)27-15-4-2-3-14(23)9-15;1-13-24-19(28-21(25-13)30-16-8-3-2-4-9-16)27-20-23-12-17(31-20)11-18(29)26-15-7-5-6-14(22)10-15;1-27-5-7-28(8-6-27)18-23-12-22-17(25-18)26-19-21-11-15(30-19)10-16(29)24-14-4-2-3-13(20)9-14;20-13-5-4-6-14(9-13)24-16(28)10-15-11-21-19(29-15)26-17-22-12-23-18(25-17)27-7-2-1-3-8-27/h4-6,14,33H,3,7-13H2,1-2H3,(H,28,34)(H,25,26,27,29,30);5-7,13H,4,8-12H2,1-3H3,(H,27,32)(H,24,25,26,28,29);3*3-10,12H,11H2,1-2H3,(H,27,30)(H,24,25,26,28,29);2-8,10H,9H2,1H3,(H,28,31)(H,25,26,27,29,30);2-9,11H,10H2,1H3,(H,27,30)(H,24,25,26,28,29);2-10,12H,11H2,1H3,(H,26,29)(H,23,24,25,27,28);2-4,9,11-12H,5-8,10H2,1H3,(H,24,29)(H,21,22,23,25,26);4-6,9,11-12H,1-3,7-8,10H2,(H,24,28)(H,21,22,23,25,26)
InChIKeyOAAONBRFLJZRBO-UHFFFAOYSA-N
MW4674.59 g/mol
LogP43.22
Rot. Bonds70

About N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide

N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide (PubChem CID 159934254) has the molecular formula C212H202Cl5F8N67O13S14 and a molecular weight of 4674.59 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide
PubChem CID159934254
Molecular FormulaC212H202Cl5F8N67O13S14
Molecular Weight4674.59 g/mol
Exact Mass4668.16
IUPAC NameN-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide
SMILESCCc1nc(Nc2ncc(CC(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(C)CC2)n1.CCc1nc(Nc2ncc(CC(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(CCO)CC2)n1.CN1CCN(c2ncnc(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)n2)CC1.Cc1ccc(Sc2nc(C)nc(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)n2)cc1.Cc1cccc(Sc2nc(C)nc(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)n2)c1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Oc2ccc(Cl)c(Cl)c2)n1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Oc2ccc(Cl)cc2)n1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Sc2ccccc2)n1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Sc2ccccc2C)n1.O=C(Cc1cnc(Nc2ncnc(N3CCCCC3)n2)s1)Nc1cccc(F)c1
InChIInChI=1S/C23H29ClN8O2S.C22H27ClN8OS.3C22H19FN6OS2.C21H15Cl2FN6O2S.C21H16ClFN6O2S.C21H17FN6OS2.C19H21FN8OS.C19H20FN7OS/c1-3-18-26-21(29-22(27-18)32-9-7-31(8-10-32)11-12-33)30-23-25-14-16(35-23)13-19(34)28-20-15(2)5-4-6-17(20)24;1-4-17-25-20(28-21(26-17)31-10-8-30(3)9-11-31)29-22-24-13-15(33-22)12-18(32)27-19-14(2)6-5-7-16(19)23;1-13-5-3-8-17(9-13)31-22-26-14(2)25-20(29-22)28-21-24-12-18(32-21)11-19(30)27-16-7-4-6-15(23)10-16;1-13-6-3-4-9-18(13)32-22-26-14(2)25-20(29-22)28-21-24-12-17(31-21)11-19(30)27-16-8-5-7-15(23)10-16;1-13-6-8-17(9-7-13)31-22-26-14(2)25-20(29-22)28-21-24-12-18(32-21)11-19(30)27-16-5-3-4-15(23)10-16;1-11-26-19(29-20(27-11)32-14-5-6-16(22)17(23)8-14)30-21-25-10-15(33-21)9-18(31)28-13-4-2-3-12(24)7-13;1-12-25-19(28-20(26-12)31-16-7-5-13(22)6-8-16)29-21-24-11-17(32-21)10-18(30)27-15-4-2-3-14(23)9-15;1-13-24-19(28-21(25-13)30-16-8-3-2-4-9-16)27-20-23-12-17(31-20)11-18(29)26-15-7-5-6-14(22)10-15;1-27-5-7-28(8-6-27)18-23-12-22-17(25-18)26-19-21-11-15(30-19)10-16(29)24-14-4-2-3-13(20)9-14;20-13-5-4-6-14(9-13)24-16(28)10-15-11-21-19(29-15)26-17-22-12-23-18(25-17)27-7-2-1-3-8-27/h4-6,14,33H,3,7-13H2,1-2H3,(H,28,34)(H,25,26,27,29,30);5-7,13H,4,8-12H2,1-3H3,(H,27,32)(H,24,25,26,28,29);3*3-10,12H,11H2,1-2H3,(H,27,30)(H,24,25,26,28,29);2-8,10H,9H2,1H3,(H,28,31)(H,25,26,27,29,30);2-9,11H,10H2,1H3,(H,27,30)(H,24,25,26,28,29);2-10,12H,11H2,1H3,(H,26,29)(H,23,24,25,27,28);2-4,9,11-12H,5-8,10H2,1H3,(H,24,29)(H,21,22,23,25,26);4-6,9,11-12H,1-3,7-8,10H2,(H,24,28)(H,21,22,23,25,26)
InChIKeyOAAONBRFLJZRBO-UHFFFAOYSA-N
XLogP43.22
TPSA988.27 Ų
H-Bond Donors21
H-Bond Acceptors84
Rotatable Bonds70
Heavy Atoms319
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004674.59
LogP ≤ 543.22
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1084

Analyze N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide 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 N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide?
The IUPAC name of N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide (CID 159934254) is N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide is CCc1nc(Nc2ncc(CC(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(C)CC2)n1.CCc1nc(Nc2ncc(CC(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(CCO)CC2)n1.CN1CCN(c2ncnc(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)n2)CC1.Cc1ccc(Sc2nc(C)nc(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)n2)cc1.Cc1cccc(Sc2nc(C)nc(Nc3ncc(CC(=O)Nc4cccc(F)c4)s3)n2)c1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Oc2ccc(Cl)c(Cl)c2)n1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Oc2ccc(Cl)cc2)n1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Sc2ccccc2)n1.Cc1nc(Nc2ncc(CC(=O)Nc3cccc(F)c3)s2)nc(Sc2ccccc2C)n1.O=C(Cc1cnc(Nc2ncnc(N3CCCCC3)n2)s1)Nc1cccc(F)c1.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide?
The InChIKey is OAAONBRFLJZRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29ClN8O2S.C22H27ClN8OS.3C22H19FN6OS2.C21H15Cl2FN6O2S.C21H16ClFN6O2S.C21H17FN6OS2.C19H21FN8OS.C19H20FN7OS/c1-3-18-26-21(29-22(27-18)32-9-7-31(8-10-32)11-12-33)30-23-25-14-16(35-23)13-19(34)28-20-15(2)5-4-6-17(20)24;1-4-17-25-20(28-21(26-17)31-10-8-30(3)9-11-31)29-22-24-13-15(33-22)12-18(32)27-19-14(2)6-5-7-16(19)23;1-13-5-3-8-17(9-13)31-22-26-14(2)25-20(29-22)28-21-24-12-18(32-21)11-19(30)27-16-7-4-6-15(23)10-16;1-13-6-3-4-9-18(13)32-22-26-14(2)25-20(29-22)28-21-24-12-17(31-21)11-19(30)27-16-8-5-7-15(23)10-16;1-13-6-8-17(9-7-13)31-22-26-14(2)25-20(29-22)28-21-24-12-18(32-21)11-19(30)27-16-5-3-4-15(23)10-16;1-11-26-19(29-20(27-11)32-14-5-6-16(22)17(23)8-14)30-21-25-10-15(33-21)9-18(31)28-13-4-2-3-12(24)7-13;1-12-25-19(28-20(26-12)31-16-7-5-13(22)6-8-16)29-21-24-11-17(32-21)10-18(30)27-15-4-2-3-14(23)9-15;1-13-24-19(28-21(25-13)30-16-8-3-2-4-9-16)27-20-23-12-17(31-20)11-18(29)26-15-7-5-6-14(22)10-15;1-27-5-7-28(8-6-27)18-23-12-22-17(25-18)26-19-21-11-15(30-19)10-16(29)24-14-4-2-3-13(20)9-14;20-13-5-4-6-14(9-13)24-16(28)10-15-11-21-19(29-15)26-17-22-12-23-18(25-17)27-7-2-1-3-8-27/h4-6,14,33H,3,7-13H2,1-2H3,(H,28,34)(H,25,26,27,29,30);5-7,13H,4,8-12H2,1-3H3,(H,27,32)(H,24,25,26,28,29);3*3-10,12H,11H2,1-2H3,(H,27,30)(H,24,25,26,28,29);2-8,10H,9H2,1H3,(H,28,31)(H,25,26,27,29,30);2-9,11H,10H2,1H3,(H,27,30)(H,24,25,26,28,29);2-10,12H,11H2,1H3,(H,26,29)(H,23,24,25,27,28);2-4,9,11-12H,5-8,10H2,1H3,(H,24,29)(H,21,22,23,25,26);4-6,9,11-12H,1-3,7-8,10H2,(H,24,28)(H,21,22,23,25,26).
What are the key properties of N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide?
N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide has a molecular weight of 4674.59 g/mol, XLogP of 43.22, 70 rotatable bonds, 21 hydrogen bond donors, and 84 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(2-chloro-6-methylphenyl)-2-[2-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;2-[2-[[4-(4-chlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;2-[2-[[4-(3,4-dichlorophenoxy)-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]-N-(3-fluorophenyl)acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(2-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-methyl-6-(4-methylphenyl)sulfanyl-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-methyl-6-phenylsulfanyl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[[4-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazol-5-yl]acetamide;N-(3-fluorophenyl)-2-[2-[(4-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazol-5-yl]acetamide is sourced from PubChem (CID 159934254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).