N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide

C123H134Cl5N55O13 — CID 159580024

IUPACN-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide
SMILESCCc1nc(NCCN(C)C)nc(Nc2nnc(C(=O)Nc3ccccc3)o2)n1.CCc1nc(Nc2nnc(C(=O)Nc3c(C)cccc3Cl)o2)nc(N2CCN(C)CC2)n1.CCc1nc(Nc2nnc(C(=O)Nc3c(C)cccc3Cl)o2)nc(N2CCN(CCO)CC2)n1.CCc1nc(Nc2nnc(C(=O)Nc3c(C)cccc3Cl)o2)nc(N2CCN(c3ccncc3)CC2)n1.Cc1cccc(Cl)c1NC(=O)c1nnc(Nc2nc(-c3ccccn3)nc(N(C)C)n2)o1.Cc1cccc(Cl)c1NC(=O)c1nnc(Nc2nc(-c3cccnc3)nc(N(C)C)n2)o1
InChIInChI=1S/C24H25ClN10O2.C21H26ClN9O3.2C20H18ClN9O2.C20H24ClN9O2.C18H23N9O2/c1-3-18-27-22(30-23(28-18)35-13-11-34(12-14-35)16-7-9-26-10-8-16)31-24-33-32-21(37-24)20(36)29-19-15(2)5-4-6-17(19)25;1-3-15-23-19(26-20(24-15)31-9-7-30(8-10-31)11-12-32)27-21-29-28-18(34-21)17(33)25-16-13(2)5-4-6-14(16)22;1-11-6-4-8-13(21)14(11)23-16(31)17-28-29-20(32-17)27-18-24-15(12-7-5-9-22-10-12)25-19(26-18)30(2)3;1-11-7-6-8-12(21)14(11)23-16(31)17-28-29-20(32-17)27-18-24-15(13-9-4-5-10-22-13)25-19(26-18)30(2)3;1-4-14-22-18(25-19(23-14)30-10-8-29(3)9-11-30)26-20-28-27-17(32-20)16(31)24-15-12(2)6-5-7-13(15)21;1-4-13-21-16(19-10-11-27(2)3)23-17(22-13)24-18-26-25-15(29-18)14(28)20-12-8-6-5-7-9-12/h4-10H,3,11-14H2,1-2H3,(H,29,36)(H,27,28,30,31,33);4-6,32H,3,7-12H2,1-2H3,(H,25,33)(H,23,24,26,27,29);2*4-10H,1-3H3,(H,23,31)(H,24,25,26,27,29);5-7H,4,8-11H2,1-3H3,(H,24,31)(H,22,23,25,26,28);5-9H,4,10-11H2,1-3H3,(H,20,28)(H2,19,21,22,23,24,26)
InChIKeyMIWZAQYEZHPPOH-UHFFFAOYSA-N
MW2768.06 g/mol
LogP16.38
Rot. Bonds42

About N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide

N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide (PubChem CID 159580024) has the molecular formula C123H134Cl5N55O13 and a molecular weight of 2768.06 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide
PubChem CID159580024
Molecular FormulaC123H134Cl5N55O13
Molecular Weight2768.06 g/mol
Exact Mass2764.00
IUPAC NameN-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide
SMILESCCc1nc(NCCN(C)C)nc(Nc2nnc(C(=O)Nc3ccccc3)o2)n1.CCc1nc(Nc2nnc(C(=O)Nc3c(C)cccc3Cl)o2)nc(N2CCN(C)CC2)n1.CCc1nc(Nc2nnc(C(=O)Nc3c(C)cccc3Cl)o2)nc(N2CCN(CCO)CC2)n1.CCc1nc(Nc2nnc(C(=O)Nc3c(C)cccc3Cl)o2)nc(N2CCN(c3ccncc3)CC2)n1.Cc1cccc(Cl)c1NC(=O)c1nnc(Nc2nc(-c3ccccn3)nc(N(C)C)n2)o1.Cc1cccc(Cl)c1NC(=O)c1nnc(Nc2nc(-c3cccnc3)nc(N(C)C)n2)o1
InChIInChI=1S/C24H25ClN10O2.C21H26ClN9O3.2C20H18ClN9O2.C20H24ClN9O2.C18H23N9O2/c1-3-18-27-22(30-23(28-18)35-13-11-34(12-14-35)16-7-9-26-10-8-16)31-24-33-32-21(37-24)20(36)29-19-15(2)5-4-6-17(19)25;1-3-15-23-19(26-20(24-15)31-9-7-30(8-10-31)11-12-32)27-21-29-28-18(34-21)17(33)25-16-13(2)5-4-6-14(16)22;1-11-6-4-8-13(21)14(11)23-16(31)17-28-29-20(32-17)27-18-24-15(12-7-5-9-22-10-12)25-19(26-18)30(2)3;1-11-7-6-8-12(21)14(11)23-16(31)17-28-29-20(32-17)27-18-24-15(13-9-4-5-10-22-13)25-19(26-18)30(2)3;1-4-14-22-18(25-19(23-14)30-10-8-29(3)9-11-30)26-20-28-27-17(32-20)16(31)24-15-12(2)6-5-7-13(15)21;1-4-13-21-16(19-10-11-27(2)3)23-17(22-13)24-18-26-25-15(29-18)14(28)20-12-8-6-5-7-9-12/h4-10H,3,11-14H2,1-2H3,(H,29,36)(H,27,28,30,31,33);4-6,32H,3,7-12H2,1-2H3,(H,25,33)(H,23,24,26,27,29);2*4-10H,1-3H3,(H,23,31)(H,24,25,26,27,29);5-7H,4,8-11H2,1-3H3,(H,24,31)(H,22,23,25,26,28);5-9H,4,10-11H2,1-3H3,(H,20,28)(H2,19,21,22,23,24,26)
InChIKeyMIWZAQYEZHPPOH-UHFFFAOYSA-N
XLogP16.38
TPSA812.41 Ų
H-Bond Donors14
H-Bond Acceptors62
Rotatable Bonds42
Heavy Atoms196
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002768.06
LogP ≤ 516.38
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1062

Analyze N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide?
The IUPAC name of N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide (CID 159580024) is N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide is CCc1nc(NCCN(C)C)nc(Nc2nnc(C(=O)Nc3ccccc3)o2)n1.CCc1nc(Nc2nnc(C(=O)Nc3c(C)cccc3Cl)o2)nc(N2CCN(C)CC2)n1.CCc1nc(Nc2nnc(C(=O)Nc3c(C)cccc3Cl)o2)nc(N2CCN(CCO)CC2)n1.CCc1nc(Nc2nnc(C(=O)Nc3c(C)cccc3Cl)o2)nc(N2CCN(c3ccncc3)CC2)n1.Cc1cccc(Cl)c1NC(=O)c1nnc(Nc2nc(-c3ccccn3)nc(N(C)C)n2)o1.Cc1cccc(Cl)c1NC(=O)c1nnc(Nc2nc(-c3cccnc3)nc(N(C)C)n2)o1.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide?
The InChIKey is MIWZAQYEZHPPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25ClN10O2.C21H26ClN9O3.2C20H18ClN9O2.C20H24ClN9O2.C18H23N9O2/c1-3-18-27-22(30-23(28-18)35-13-11-34(12-14-35)16-7-9-26-10-8-16)31-24-33-32-21(37-24)20(36)29-19-15(2)5-4-6-17(19)25;1-3-15-23-19(26-20(24-15)31-9-7-30(8-10-31)11-12-32)27-21-29-28-18(34-21)17(33)25-16-13(2)5-4-6-14(16)22;1-11-6-4-8-13(21)14(11)23-16(31)17-28-29-20(32-17)27-18-24-15(12-7-5-9-22-10-12)25-19(26-18)30(2)3;1-11-7-6-8-12(21)14(11)23-16(31)17-28-29-20(32-17)27-18-24-15(13-9-4-5-10-22-13)25-19(26-18)30(2)3;1-4-14-22-18(25-19(23-14)30-10-8-29(3)9-11-30)26-20-28-27-17(32-20)16(31)24-15-12(2)6-5-7-13(15)21;1-4-13-21-16(19-10-11-27(2)3)23-17(22-13)24-18-26-25-15(29-18)14(28)20-12-8-6-5-7-9-12/h4-10H,3,11-14H2,1-2H3,(H,29,36)(H,27,28,30,31,33);4-6,32H,3,7-12H2,1-2H3,(H,25,33)(H,23,24,26,27,29);2*4-10H,1-3H3,(H,23,31)(H,24,25,26,27,29);5-7H,4,8-11H2,1-3H3,(H,24,31)(H,22,23,25,26,28);5-9H,4,10-11H2,1-3H3,(H,20,28)(H2,19,21,22,23,24,26).
What are the key properties of N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide?
N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide has a molecular weight of 2768.06 g/mol, XLogP of 16.38, 42 rotatable bonds, 14 hydrogen bond donors, and 62 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-2-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-(dimethylamino)-6-pyridin-3-yl-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;N-(2-chloro-6-methylphenyl)-5-[[4-ethyl-6-(4-pyridin-4-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3,4-oxadiazole-2-carboxamide;5-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3,4-oxadiazole-2-carboxamide is sourced from PubChem (CID 159580024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).