About 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine
6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 158421326) has the molecular formula C143H129F15N44O3
and a molecular weight of 2796.88 g/mol. Its IUPAC name is 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine.
Frequently Asked Questions
What is the IUPAC name of 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine (CID 158421326) is 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine is CC(Nc1nc(Nc2cc(-c3ccc(F)cc3)[nH]n2)nc(C2CC2)n1)c1ccc(F)cc1F.CC(Nc1nc(Nc2cc(-c3cccc(F)c3)[nH]n2)nc(C2CC2)n1)c1ccc(F)cc1F.CC(Nc1nc(Nc2cc(-c3ccccc3F)[nH]n2)nc(C2CC2)n1)c1ccc(F)cc1F.COc1ccc(-c2cc(Nc3nc(NC(C)c4ccc(F)cc4F)nc(C4CC4)n3)n[nH]2)cc1.COc1ccc(-c2cc(Nc3nc(NC(C)c4ccc(F)cc4F)nc(C4CC4)n3)n[nH]2)cc1OC.C[C@H](Nc1nc(Nc2cc(-c3ccc4nccnc4c3)[nH]n2)nc(C2CC2)n1)c1ccc(F)cc1F.
What is the InChIKey of 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is HANHVUFZTIECRZ-VFZNITTPSA-N. The full InChI is InChI=1S/C25H21F2N9.C25H25F2N7O2.C24H23F2N7O.3C23H20F3N7/c1-13(17-6-5-16(26)11-18(17)27)30-24-32-23(14-2-3-14)33-25(34-24)31-22-12-20(35-36-22)15-4-7-19-21(10-15)29-9-8-28-19;1-13(17-8-7-16(26)11-18(17)27)28-24-30-23(14-4-5-14)31-25(32-24)29-22-12-19(33-34-22)15-6-9-20(35-2)21(10-15)36-3;1-13(18-10-7-16(25)11-19(18)26)27-23-29-22(15-3-4-15)30-24(31-23)28-21-12-20(32-33-21)14-5-8-17(34-2)9-6-14;1-12(17-9-8-16(25)10-18(17)26)27-22-29-21(14-2-3-14)30-23(31-22)28-20-11-19(32-33-20)13-4-6-15(24)7-5-13;1-12(17-8-7-16(25)10-18(17)26)27-22-29-21(13-5-6-13)30-23(31-22)28-20-11-19(32-33-20)14-3-2-4-15(24)9-14;1-12(15-9-8-14(24)10-18(15)26)27-22-29-21(13-6-7-13)30-23(31-22)28-20-11-19(32-33-20)16-4-2-3-5-17(16)25/h4-14H,2-3H2,1H3,(H3,30,31,32,33,34,35,36);6-14H,4-5H2,1-3H3,(H3,28,29,30,31,32,33,34);5-13,15H,3-4H2,1-2H3,(H3,27,28,29,30,31,32,33);4-12,14H,2-3H2,1H3,(H3,27,28,29,30,31,32,33);2-4,7-13H,5-6H2,1H3,(H3,27,28,29,30,31,32,33);2-5,8-13H,6-7H2,1H3,(H3,27,28,29,30,31,32,33)/t13-;;;;;/m0...../s1.
What are the key properties of 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine?
6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 2796.88 g/mol, XLogP of 32.39, 45 rotatable bonds, 18 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;6-cyclopropyl-2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 158421326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).