2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol

C97H87F30N37O3 — CID 161386120

IUPAC2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol
SMILESCC(C)(O)CNc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2nccc(C(F)(F)F)n2)n1.CC(Nc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C(F)(F)F)n2)n1)C(C)(C)O.CCC(C)Nc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2nccc(C(F)(F)F)n2)n1.FC(F)(F)c1cc(Nc2nc(NC3CCCCC3)nc(-c3cccc(C(F)(F)F)n3)n2)ccn1.OC1CCCC1Nc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C(F)(F)F)n2)n1
InChIInChI=1S/C21H19F6N7.C20H17F6N7O.C20H19F6N7O.C18H16F6N8O.C18H16F6N8/c22-20(23,24)15-8-4-7-14(31-15)17-32-18(29-12-5-2-1-3-6-12)34-19(33-17)30-13-9-10-28-16(11-13)21(25,26)27;21-19(22,23)14-6-2-4-12(29-14)16-31-17(28-10-7-8-27-15(9-10)20(24,25)26)33-18(32-16)30-11-3-1-5-13(11)34;1-10(18(2,3)34)28-16-31-15(12-5-4-6-13(30-12)19(21,22)23)32-17(33-16)29-11-7-8-27-14(9-11)20(24,25)26;1-16(2,33)8-27-14-30-13(12-26-6-4-10(29-12)17(19,20)21)31-15(32-14)28-9-3-5-25-11(7-9)18(22,23)24;1-3-9(2)27-15-30-14(13-26-7-5-11(29-13)17(19,20)21)31-16(32-15)28-10-4-6-25-12(8-10)18(22,23)24/h4,7-12H,1-3,5-6H2,(H2,28,29,30,32,33,34);2,4,6-9,11,13,34H,1,3,5H2,(H2,27,28,30,31,32,33);4-10,34H,1-3H3,(H2,27,28,29,31,32,33);3-7,33H,8H2,1-2H3,(H2,25,27,28,30,31,32);4-9H,3H2,1-2H3,(H2,25,27,28,30,31,32)
InChIKeyVSJHURWANJHTQR-UHFFFAOYSA-N
MW2388.96 g/mol
LogP23.37
Rot. Bonds28

About 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol

2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol (PubChem CID 161386120) has the molecular formula C97H87F30N37O3 and a molecular weight of 2388.96 g/mol. Its IUPAC name is 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol
PubChem CID161386120
Molecular FormulaC97H87F30N37O3
Molecular Weight2388.96 g/mol
Exact Mass2387.73
IUPAC Name2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol
SMILESCC(C)(O)CNc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2nccc(C(F)(F)F)n2)n1.CC(Nc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C(F)(F)F)n2)n1)C(C)(C)O.CCC(C)Nc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2nccc(C(F)(F)F)n2)n1.FC(F)(F)c1cc(Nc2nc(NC3CCCCC3)nc(-c3cccc(C(F)(F)F)n3)n2)ccn1.OC1CCCC1Nc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C(F)(F)F)n2)n1
InChIInChI=1S/C21H19F6N7.C20H17F6N7O.C20H19F6N7O.C18H16F6N8O.C18H16F6N8/c22-20(23,24)15-8-4-7-14(31-15)17-32-18(29-12-5-2-1-3-6-12)34-19(33-17)30-13-9-10-28-16(11-13)21(25,26)27;21-19(22,23)14-6-2-4-12(29-14)16-31-17(28-10-7-8-27-15(9-10)20(24,25)26)33-18(32-16)30-11-3-1-5-13(11)34;1-10(18(2,3)34)28-16-31-15(12-5-4-6-13(30-12)19(21,22)23)32-17(33-16)29-11-7-8-27-14(9-11)20(24,25)26;1-16(2,33)8-27-14-30-13(12-26-6-4-10(29-12)17(19,20)21)31-15(32-14)28-9-3-5-25-11(7-9)18(22,23)24;1-3-9(2)27-15-30-14(13-26-7-5-11(29-13)17(19,20)21)31-16(32-15)28-10-4-6-25-12(8-10)18(22,23)24/h4,7-12H,1-3,5-6H2,(H2,28,29,30,32,33,34);2,4,6-9,11,13,34H,1,3,5H2,(H2,27,28,30,31,32,33);4-10,34H,1-3H3,(H2,27,28,29,31,32,33);3-7,33H,8H2,1-2H3,(H2,25,27,28,30,31,32);4-9H,3H2,1-2H3,(H2,25,27,28,30,31,32)
InChIKeyVSJHURWANJHTQR-UHFFFAOYSA-N
XLogP23.37
TPSA529.02 Ų
H-Bond Donors13
H-Bond Acceptors40
Rotatable Bonds28
Heavy Atoms167
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002388.96
LogP ≤ 523.37
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1040

Analyze 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

Enasidenib
CID 89683805
2-[[4-[[2-(1,1-Difluoroethyl)pyridin-4-yl]amino]-6-[6-(trifluoromethyl)pyridin-2-yl]-1,3,5-triazin-2-yl]amino]-2-methylpropan-1-ol
CID 117817105
1-[4-[[2-(Trifluoromethyl)pyridin-4-yl]amino]-6-[[6-(trifluoromethyl)pyridin-2-yl]amino]-1,3,5-triazin-2-yl]piperidin-3-ol
CID 160875902
2-Methyl-2-[[4-[6-(trifluoromethyl)pyridin-2-yl]-6-[[2-(trifluoromethyl)pyridin-4-yl]amino]-1,3,5-triazin-2-yl]amino]propan-1-ol
CID 89683924
2-Methyl-1-[4-(2-trifluoromethyl-pyridin-4-ylamino)-6-(4-trifluoromethyl-pyrimidin-2-yl)-[1,3,5]triazin-2-ylamino]-propan-2-ol
CID 86690576
4-N-[(2-methyloxolan-2-yl)methyl]-2-N-[2-(trifluoromethyl)pyridin-4-yl]-6-[6-(trifluoromethyl)pyridin-2-yl]-1,3,5-triazine-2,4-diamine
CID 89683895
2-[[4-[6-(Trifluoromethyl)pyridin-2-yl]-6-[[2-(trifluoromethyl)pyridin-4-yl]amino]-1,3,5-triazin-2-yl]amino]propan-1-ol
CID 89683900
2-[[4-[6-(Trifluoromethyl)pyridin-2-yl]-6-[[2-(trifluoromethyl)pyridin-4-yl]amino]-1,3,5-triazin-2-yl]amino]cyclopropan-1-ol
CID 89684017
1-[(4-{[2-(1,1-Difluoroethyl)pyridin-4-yl]amino}-6-[6-(trifluoromethyl)pyridin-2-yl]-1,3,5-triazin-2-yl)amino]-2-methylpropan-2-ol
CID 89684019
3-[[4-[6-(Trifluoromethyl)pyridin-2-yl]-6-[[2-(trifluoromethyl)pyridin-4-yl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol
CID 89684023
1-[[4-[6-(1,1-Difluoroethyl)pyridin-2-yl]-6-[[2-(trifluoromethyl)pyridin-4-yl]amino]-1,3,5-triazin-2-yl]amino]-2-methylpropan-2-ol
CID 89684038
2-Methyl-3-[[4-[6-(trifluoromethyl)pyridin-2-yl]-6-[[2-(trifluoromethyl)pyridin-4-yl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol
CID 89684040

Frequently Asked Questions

What is the IUPAC name of 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol?
The IUPAC name of 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol (CID 161386120) is 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol.
What is the SMILES notation for 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol?
The canonical SMILES for 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol is CC(C)(O)CNc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2nccc(C(F)(F)F)n2)n1.CC(Nc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C(F)(F)F)n2)n1)C(C)(C)O.CCC(C)Nc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2nccc(C(F)(F)F)n2)n1.FC(F)(F)c1cc(Nc2nc(NC3CCCCC3)nc(-c3cccc(C(F)(F)F)n3)n2)ccn1.OC1CCCC1Nc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C(F)(F)F)n2)n1.
What is the InChIKey of 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol?
The InChIKey is VSJHURWANJHTQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19F6N7.C20H17F6N7O.C20H19F6N7O.C18H16F6N8O.C18H16F6N8/c22-20(23,24)15-8-4-7-14(31-15)17-32-18(29-12-5-2-1-3-6-12)34-19(33-17)30-13-9-10-28-16(11-13)21(25,26)27;21-19(22,23)14-6-2-4-12(29-14)16-31-17(28-10-7-8-27-15(9-10)20(24,25)26)33-18(32-16)30-11-3-1-5-13(11)34;1-10(18(2,3)34)28-16-31-15(12-5-4-6-13(30-12)19(21,22)23)32-17(33-16)29-11-7-8-27-14(9-11)20(24,25)26;1-16(2,33)8-27-14-30-13(12-26-6-4-10(29-12)17(19,20)21)31-15(32-14)28-9-3-5-25-11(7-9)18(22,23)24;1-3-9(2)27-15-30-14(13-26-7-5-11(29-13)17(19,20)21)31-16(32-15)28-10-4-6-25-12(8-10)18(22,23)24/h4,7-12H,1-3,5-6H2,(H2,28,29,30,32,33,34);2,4,6-9,11,13,34H,1,3,5H2,(H2,27,28,30,31,32,33);4-10,34H,1-3H3,(H2,27,28,29,31,32,33);3-7,33H,8H2,1-2H3,(H2,25,27,28,30,31,32);4-9H,3H2,1-2H3,(H2,25,27,28,30,31,32).
What are the key properties of 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol?
2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol has a molecular weight of 2388.96 g/mol, XLogP of 23.37, 28 rotatable bonds, 13 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-butan-2-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazine-2,4-diamine;2-N-cyclohexyl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine;2-methyl-1-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]propan-2-ol;2-methyl-3-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]butan-2-ol;2-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol is sourced from PubChem (CID 161386120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).