[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine

C279H290N64O20S12 — CID 157497995

IUPAC[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine
SMILESC(=C/c1cccc2[nH]ccc12)\c1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1.CCNC(=O)N1CCC(S(=O)(=O)c2ccc(Nc3ncc(/C=C/c4ccc5nc(N)sc5c4)cn3)cc2)CC1.CN1CCN(C(=O)c2ccc(Nc3ncc(/C=C/c4cccc5[nH]ccc45)cn3)cc2)CC1.CN1CCN(S(=O)(=O)c2cccc(Nc3ncc(/C=C/c4cccc5[nH]ccc45)cn3)c2)CC1.COc1cccc(/C=C/c2cnc(Nc3ccc(S(=O)(=O)C4CCNCC4)cc3)nc2)c1.Nc1nc2ccc(/C=C/c3cnc(Nc4ccc(C(=O)N5CCNCC5)cc4)nc3)cc2s1.Nc1nc2ccc(/C=C/c3cnc(Nc4ccc(S(=O)CCN5CCOCC5)cc4)nc3)cc2s1.Nc1nc2ccc(/C=C/c3cnc(Nc4ccc(SCCN5CCOCC5)cc4)nc3)cc2s1.O=S(=O)(CCCN1CCCC1)c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1.O=S(=O)(NCCN1CCCC1)c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1.O=S(=O)(c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1)N1CCNCC1
InChIInChI=1S/C27H29N7O3S2.C27H29N5O2S.C26H28N6O2S.C26H26N6O.C26H27N5O.C25H26N6O2S2.C25H26N6O2S.C25H26N6OS2.C24H23N7OS.C24H24N6O2S.C24H26N4O3S/c1-2-29-27(35)34-13-11-22(12-14-34)39(36,37)21-8-6-20(7-9-21)32-26-30-16-19(17-31-26)4-3-18-5-10-23-24(15-18)38-25(28)33-23;33-35(34,18-4-17-32-15-1-2-16-32)24-11-9-23(10-12-24)31-27-29-19-21(20-30-27)7-8-22-5-3-6-26-25(22)13-14-28-26;33-35(34,30-14-17-32-15-1-2-16-32)23-10-8-22(9-11-23)31-26-28-18-20(19-29-26)6-7-21-4-3-5-25-24(21)12-13-27-25;1-31-13-15-32(16-14-31)25(33)21-7-9-22(10-8-21)30-26-28-17-19(18-29-26)5-6-20-3-2-4-24-23(20)11-12-27-24;1-2-15-31(14-1)16-17-32-23-10-8-22(9-11-23)30-26-28-18-20(19-29-26)6-7-21-4-3-5-25-24(21)12-13-27-25;26-24-30-22-8-3-18(15-23(22)34-24)1-2-19-16-27-25(28-17-19)29-20-4-6-21(7-5-20)35(32)14-11-31-9-12-33-13-10-31;1-30-12-14-31(15-13-30)34(32,33)22-6-3-5-21(16-22)29-25-27-17-19(18-28-25)8-9-20-4-2-7-24-23(20)10-11-26-24;26-24-30-22-8-3-18(15-23(22)34-24)1-2-19-16-27-25(28-17-19)29-20-4-6-21(7-5-20)33-14-11-31-9-12-32-13-10-31;25-23-30-20-8-3-16(13-21(20)33-23)1-2-17-14-27-24(28-15-17)29-19-6-4-18(5-7-19)22(32)31-11-9-26-10-12-31;31-33(32,30-14-12-25-13-15-30)21-8-6-20(7-9-21)29-24-27-16-18(17-28-24)4-5-19-2-1-3-23-22(19)10-11-26-23;1-31-21-4-2-3-18(15-21)5-6-19-16-26-24(27-17-19)28-20-7-9-22(10-8-20)32(29,30)23-11-13-25-14-12-23/h3-10,15-17,22H,2,11-14H2,1H3,(H2,28,33)(H,29,35)(H,30,31,32);3,5-14,19-20,28H,1-2,4,15-18H2,(H,29,30,31);3-13,18-19,27,30H,1-2,14-17H2,(H,28,29,31);2-12,17-18,27H,13-16H2,1H3,(H,28,29,30);3-13,18-19,27H,1-2,14-17H2,(H,28,29,30);1-8,15-17H,9-14H2,(H2,26,30)(H,27,28,29);2-11,16-18,26H,12-15H2,1H3,(H,27,28,29);1-8,15-17H,9-14H2,(H2,26,30)(H,27,28,29);1-8,13-15,26H,9-12H2,(H2,25,30)(H,27,28,29);1-11,16-17,25-26H,12-15H2,(H,27,28,29);2-10,15-17,23,25H,11-14H2,1H3,(H,26,27,28)/b4-3+;8-7+;7-6+;6-5+;7-6+;2-1+;9-8+;2*2-1+;5-4+;6-5+
InChIKeyBYBFXNDQQFJEOX-AUCSRJRGSA-N
MW5244.62 g/mol
LogP47.39
Rot. Bonds78

About [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine

[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine (PubChem CID 157497995) has the molecular formula C279H290N64O20S12 and a molecular weight of 5244.62 g/mol. Its IUPAC name is [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine.

Molecular Properties

Compound Name[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine
PubChem CID157497995
Molecular FormulaC279H290N64O20S12
Molecular Weight5244.62 g/mol
Exact Mass5240.03
IUPAC Name[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine
SMILESC(=C/c1cccc2[nH]ccc12)\c1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1.CCNC(=O)N1CCC(S(=O)(=O)c2ccc(Nc3ncc(/C=C/c4ccc5nc(N)sc5c4)cn3)cc2)CC1.CN1CCN(C(=O)c2ccc(Nc3ncc(/C=C/c4cccc5[nH]ccc45)cn3)cc2)CC1.CN1CCN(S(=O)(=O)c2cccc(Nc3ncc(/C=C/c4cccc5[nH]ccc45)cn3)c2)CC1.COc1cccc(/C=C/c2cnc(Nc3ccc(S(=O)(=O)C4CCNCC4)cc3)nc2)c1.Nc1nc2ccc(/C=C/c3cnc(Nc4ccc(C(=O)N5CCNCC5)cc4)nc3)cc2s1.Nc1nc2ccc(/C=C/c3cnc(Nc4ccc(S(=O)CCN5CCOCC5)cc4)nc3)cc2s1.Nc1nc2ccc(/C=C/c3cnc(Nc4ccc(SCCN5CCOCC5)cc4)nc3)cc2s1.O=S(=O)(CCCN1CCCC1)c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1.O=S(=O)(NCCN1CCCC1)c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1.O=S(=O)(c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1)N1CCNCC1
InChIInChI=1S/C27H29N7O3S2.C27H29N5O2S.C26H28N6O2S.C26H26N6O.C26H27N5O.C25H26N6O2S2.C25H26N6O2S.C25H26N6OS2.C24H23N7OS.C24H24N6O2S.C24H26N4O3S/c1-2-29-27(35)34-13-11-22(12-14-34)39(36,37)21-8-6-20(7-9-21)32-26-30-16-19(17-31-26)4-3-18-5-10-23-24(15-18)38-25(28)33-23;33-35(34,18-4-17-32-15-1-2-16-32)24-11-9-23(10-12-24)31-27-29-19-21(20-30-27)7-8-22-5-3-6-26-25(22)13-14-28-26;33-35(34,30-14-17-32-15-1-2-16-32)23-10-8-22(9-11-23)31-26-28-18-20(19-29-26)6-7-21-4-3-5-25-24(21)12-13-27-25;1-31-13-15-32(16-14-31)25(33)21-7-9-22(10-8-21)30-26-28-17-19(18-29-26)5-6-20-3-2-4-24-23(20)11-12-27-24;1-2-15-31(14-1)16-17-32-23-10-8-22(9-11-23)30-26-28-18-20(19-29-26)6-7-21-4-3-5-25-24(21)12-13-27-25;26-24-30-22-8-3-18(15-23(22)34-24)1-2-19-16-27-25(28-17-19)29-20-4-6-21(7-5-20)35(32)14-11-31-9-12-33-13-10-31;1-30-12-14-31(15-13-30)34(32,33)22-6-3-5-21(16-22)29-25-27-17-19(18-28-25)8-9-20-4-2-7-24-23(20)10-11-26-24;26-24-30-22-8-3-18(15-23(22)34-24)1-2-19-16-27-25(28-17-19)29-20-4-6-21(7-5-20)33-14-11-31-9-12-32-13-10-31;25-23-30-20-8-3-16(13-21(20)33-23)1-2-17-14-27-24(28-15-17)29-19-6-4-18(5-7-19)22(32)31-11-9-26-10-12-31;31-33(32,30-14-12-25-13-15-30)21-8-6-20(7-9-21)29-24-27-16-18(17-28-24)4-5-19-2-1-3-23-22(19)10-11-26-23;1-31-21-4-2-3-18(15-21)5-6-19-16-26-24(27-17-19)28-20-7-9-22(10-8-20)32(29,30)23-11-13-25-14-12-23/h3-10,15-17,22H,2,11-14H2,1H3,(H2,28,33)(H,29,35)(H,30,31,32);3,5-14,19-20,28H,1-2,4,15-18H2,(H,29,30,31);3-13,18-19,27,30H,1-2,14-17H2,(H,28,29,31);2-12,17-18,27H,13-16H2,1H3,(H,28,29,30);3-13,18-19,27H,1-2,14-17H2,(H,28,29,30);1-8,15-17H,9-14H2,(H2,26,30)(H,27,28,29);2-11,16-18,26H,12-15H2,1H3,(H,27,28,29);1-8,15-17H,9-14H2,(H2,26,30)(H,27,28,29);1-8,13-15,26H,9-12H2,(H2,25,30)(H,27,28,29);1-11,16-17,25-26H,12-15H2,(H,27,28,29);2-10,15-17,23,25H,11-14H2,1H3,(H,26,27,28)/b4-3+;8-7+;7-6+;6-5+;7-6+;2-1+;9-8+;2*2-1+;5-4+;6-5+
InChIKeyBYBFXNDQQFJEOX-AUCSRJRGSA-N
XLogP47.39
TPSA1075.36 Ų
H-Bond Donors26
H-Bond Acceptors76
Rotatable Bonds78
Heavy Atoms375
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005244.62
LogP ≤ 547.39
H-Bond Donors ≤ 526
H-Bond Acceptors ≤ 1076

Analyze [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine with MolForge

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Related Compounds

4-N-[4-chloro-3-(trifluoromethyl)phenyl]-5-methyl-2-N-(4-piperidin-4-yloxyphenyl)pyrimidine-2,4-diamine;4-N-(1H-indol-4-yl)-5-methyl-2-N-[4-(morpholin-4-ylmethyl)phenyl]pyrimidine-2,4-diamine;4-N-(1H-indol-4-yl)-5-methyl-2-N-[4-(piperazin-1-ylmethyl)phenyl]pyrimidine-2,4-diamine;2-methyl-3-[[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]benzamide;3-[[5-methyl-2-[4-(2-pyrrolidin-1-ylethoxy)anilino]pyrimidin-4-yl]amino]benzenesulfonamide
CID 159720817
tert-butyl 4-[[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonylmethyl]piperidine-1-carboxylate
CID 58901725
2-[4-[4-[[5-[2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonylpiperidin-1-yl]ethanol
CID 69443023
4-[[7-(2-chloro-5-hydroxyphenyl)-6-methyl-1,2,4-benzotriazin-3-yl]amino]-N-methyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;[4-[[7-(2-chloro-5-hydroxyphenyl)-5-methyl-1,2,4-benzotriazin-3-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[7-(2-chloro-5-hydroxyphenyl)-5-methyl-1,2,4-benzotriazin-3-yl]amino]-N-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;4-[[7-(2-chloro-5-hydroxyphenyl)-5-methyl-1,2,4-benzotriazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;4-chloro-3-[5-methyl-3-[3-(2-pyrrolidin-1-ylethoxy)anilino]-1,2,4-benzotriazin-7-yl]phenol;4-chloro-3-[5-methyl-3-[4-(3-pyrrolidin-1-ylpropylsulfonyl)anilino]-1,2,4-benzotriazin-7-yl]phenol
CID 158500314
methyl 2-[[1-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonylpiperidin-4-yl]amino]acetate
CID 58901891
4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]-N-piperidin-4-ylbenzenesulfonamide
CID 16662370
3-[2-[4-methyl-2-(4-piperidin-4-ylsulfonylanilino)pyrimidin-5-yl]ethenyl]phenol
CID 69442412
4-[[6-[(E)-2-(3-hydroxyphenyl)ethenyl]-1,2,4-triazin-3-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 16662591
6-methyl-N-[6-[(E)-2-[2-(4-piperazin-1-ylsulfonylanilino)pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-yl]-5-(trifluoromethyl)cyclohexa-2,4-diene-1-carboxamide
CID 143457483
3-[2-[2-[4-(1,4-diazepan-1-ylsulfonyl)anilino]pyrimidin-5-yl]ethenyl]benzenesulfonamide
CID 69443908
[4-[[5-[2-(1H-indazol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone
CID 69445618
4-N-[3-(cyclohexylmethylsulfonyl)phenyl]-5-methyl-2-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidine-2,4-diamine;N,N-diethyl-3-[[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]benzenesulfonamide;ethyl 2-methyl-3-[[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]benzoate;5-methyl-4-N-(4-methyl-3-methylsulfonylphenyl)-2-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidine-2,4-diamine;3-[[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]benzamide;5-methyl-2-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-N-(3-morpholin-4-ylsulfonylphenyl)pyrimidine-2,4-diamine
CID 157108316

Frequently Asked Questions

What is the IUPAC name of [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine?
The IUPAC name of [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine (CID 157497995) is [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine.
What is the SMILES notation for [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine?
The canonical SMILES for [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine is C(=C/c1cccc2[nH]ccc12)\c1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1.CCNC(=O)N1CCC(S(=O)(=O)c2ccc(Nc3ncc(/C=C/c4ccc5nc(N)sc5c4)cn3)cc2)CC1.CN1CCN(C(=O)c2ccc(Nc3ncc(/C=C/c4cccc5[nH]ccc45)cn3)cc2)CC1.CN1CCN(S(=O)(=O)c2cccc(Nc3ncc(/C=C/c4cccc5[nH]ccc45)cn3)c2)CC1.COc1cccc(/C=C/c2cnc(Nc3ccc(S(=O)(=O)C4CCNCC4)cc3)nc2)c1.Nc1nc2ccc(/C=C/c3cnc(Nc4ccc(C(=O)N5CCNCC5)cc4)nc3)cc2s1.Nc1nc2ccc(/C=C/c3cnc(Nc4ccc(S(=O)CCN5CCOCC5)cc4)nc3)cc2s1.Nc1nc2ccc(/C=C/c3cnc(Nc4ccc(SCCN5CCOCC5)cc4)nc3)cc2s1.O=S(=O)(CCCN1CCCC1)c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1.O=S(=O)(NCCN1CCCC1)c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1.O=S(=O)(c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1)N1CCNCC1.
What is the InChIKey of [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine?
The InChIKey is BYBFXNDQQFJEOX-AUCSRJRGSA-N. The full InChI is InChI=1S/C27H29N7O3S2.C27H29N5O2S.C26H28N6O2S.C26H26N6O.C26H27N5O.C25H26N6O2S2.C25H26N6O2S.C25H26N6OS2.C24H23N7OS.C24H24N6O2S.C24H26N4O3S/c1-2-29-27(35)34-13-11-22(12-14-34)39(36,37)21-8-6-20(7-9-21)32-26-30-16-19(17-31-26)4-3-18-5-10-23-24(15-18)38-25(28)33-23;33-35(34,18-4-17-32-15-1-2-16-32)24-11-9-23(10-12-24)31-27-29-19-21(20-30-27)7-8-22-5-3-6-26-25(22)13-14-28-26;33-35(34,30-14-17-32-15-1-2-16-32)23-10-8-22(9-11-23)31-26-28-18-20(19-29-26)6-7-21-4-3-5-25-24(21)12-13-27-25;1-31-13-15-32(16-14-31)25(33)21-7-9-22(10-8-21)30-26-28-17-19(18-29-26)5-6-20-3-2-4-24-23(20)11-12-27-24;1-2-15-31(14-1)16-17-32-23-10-8-22(9-11-23)30-26-28-18-20(19-29-26)6-7-21-4-3-5-25-24(21)12-13-27-25;26-24-30-22-8-3-18(15-23(22)34-24)1-2-19-16-27-25(28-17-19)29-20-4-6-21(7-5-20)35(32)14-11-31-9-12-33-13-10-31;1-30-12-14-31(15-13-30)34(32,33)22-6-3-5-21(16-22)29-25-27-17-19(18-28-25)8-9-20-4-2-7-24-23(20)10-11-26-24;26-24-30-22-8-3-18(15-23(22)34-24)1-2-19-16-27-25(28-17-19)29-20-4-6-21(7-5-20)33-14-11-31-9-12-32-13-10-31;25-23-30-20-8-3-16(13-21(20)33-23)1-2-17-14-27-24(28-15-17)29-19-6-4-18(5-7-19)22(32)31-11-9-26-10-12-31;31-33(32,30-14-12-25-13-15-30)21-8-6-20(7-9-21)29-24-27-16-18(17-28-24)4-5-19-2-1-3-23-22(19)10-11-26-23;1-31-21-4-2-3-18(15-21)5-6-19-16-26-24(27-17-19)28-20-7-9-22(10-8-20)32(29,30)23-11-13-25-14-12-23/h3-10,15-17,22H,2,11-14H2,1H3,(H2,28,33)(H,29,35)(H,30,31,32);3,5-14,19-20,28H,1-2,4,15-18H2,(H,29,30,31);3-13,18-19,27,30H,1-2,14-17H2,(H,28,29,31);2-12,17-18,27H,13-16H2,1H3,(H,28,29,30);3-13,18-19,27H,1-2,14-17H2,(H,28,29,30);1-8,15-17H,9-14H2,(H2,26,30)(H,27,28,29);2-11,16-18,26H,12-15H2,1H3,(H,27,28,29);1-8,15-17H,9-14H2,(H2,26,30)(H,27,28,29);1-8,13-15,26H,9-12H2,(H2,25,30)(H,27,28,29);1-11,16-17,25-26H,12-15H2,(H,27,28,29);2-10,15-17,23,25H,11-14H2,1H3,(H,26,27,28)/b4-3+;8-7+;7-6+;6-5+;7-6+;2-1+;9-8+;2*2-1+;5-4+;6-5+.
What are the key properties of [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine?
[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine has a molecular weight of 5244.62 g/mol, XLogP of 47.39, 78 rotatable bonds, 26 hydrogen bond donors, and 76 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone;4-[4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]sulfonyl-N-ethylpiperidine-1-carboxamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine;[4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;4-[[5-[(E)-2-(1H-indol-4-yl)ethenyl]pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine;5-[(E)-2-(1H-indol-4-yl)ethenyl]-N-[4-(3-pyrrolidin-1-ylpropylsulfonyl)phenyl]pyrimidin-2-amine;5-[(E)-2-(3-methoxyphenyl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfanyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine;6-[(E)-2-[2-[4-(2-morpholin-4-ylethylsulfinyl)anilino]pyrimidin-5-yl]ethenyl]-1,3-benzothiazol-2-amine is sourced from PubChem (CID 157497995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).