3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone

C174H154F10N32O13S7 — CID 165036141

IUPAC3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone
SMILESCOc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCC(c2ccc(F)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCN(Cc2ccc(C)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)Nc1cnn(C(C)c2ccc(F)cc2)c1.Nc1nc2ccc(-c3cnc4c(c3)C(=O)N(Cc3cc(C(F)(F)F)ccc3F)CC4)cc2s1.Nc1nc2ccc(-c3cnc4c(c3)C(=O)N(Cc3cc(F)cc(F)c3OC3CC3)CC4)cc2s1
InChIInChI=1S/C26H25FN4O2S.C26H27N5O2S.C25H20F2N4O2S.C25H21FN6O2S.C25H23FN4O2S.C24H22FN5O2S.C23H16F4N4OS/c1-33-24-21(13-19(15-29-24)18-4-7-22-23(14-18)34-26(28)30-22)25(32)31-10-8-17(9-11-31)12-16-2-5-20(27)6-3-16;1-17-3-5-18(6-4-17)16-30-9-11-31(12-10-30)25(32)21-13-20(15-28-24(21)33-2)19-7-8-22-23(14-19)34-26(27)29-22;26-16-7-15(23(19(27)10-16)33-17-2-3-17)12-31-6-5-20-18(24(31)32)8-14(11-29-20)13-1-4-21-22(9-13)34-25(28)30-21;1-14(15-3-6-18(26)7-4-15)32-13-19(12-29-32)30-23(33)20-9-17(11-28-24(20)34-2)16-5-8-21-22(10-16)35-25(27)31-21;1-32-23-20(12-18(14-28-23)17-4-7-21-22(13-17)33-25(27)29-21)24(31)30-10-8-16(9-11-30)15-2-5-19(26)6-3-15;1-32-22-19(12-16(14-27-22)15-2-7-20-21(13-15)33-24(26)28-20)23(31)30-10-8-29(9-11-30)18-5-3-17(25)4-6-18;24-17-3-2-15(23(25,26)27)7-14(17)11-31-6-5-18-16(21(31)32)8-13(10-29-18)12-1-4-19-20(9-12)33-22(28)30-19/h2-7,13-15,17H,8-12H2,1H3,(H2,28,30);3-8,13-15H,9-12,16H2,1-2H3,(H2,27,29);1,4,7-11,17H,2-3,5-6,12H2,(H2,28,30);3-14H,1-2H3,(H2,27,31)(H,30,33);2-7,12-14,16H,8-11H2,1H3,(H2,27,29);2-7,12-14H,8-11H2,1H3,(H2,26,28);1-4,7-10H,5-6,11H2,(H2,28,30)
InChIKeyNKGNEQPUZSORNV-UHFFFAOYSA-N
MW3315.81 g/mol
LogP33.96
Rot. Bonds32

About 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone

3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone (PubChem CID 165036141) has the molecular formula C174H154F10N32O13S7 and a molecular weight of 3315.81 g/mol. Its IUPAC name is 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Name3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone
PubChem CID165036141
Molecular FormulaC174H154F10N32O13S7
Molecular Weight3315.81 g/mol
Exact Mass3313.03
IUPAC Name3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone
SMILESCOc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCC(c2ccc(F)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCN(Cc2ccc(C)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)Nc1cnn(C(C)c2ccc(F)cc2)c1.Nc1nc2ccc(-c3cnc4c(c3)C(=O)N(Cc3cc(C(F)(F)F)ccc3F)CC4)cc2s1.Nc1nc2ccc(-c3cnc4c(c3)C(=O)N(Cc3cc(F)cc(F)c3OC3CC3)CC4)cc2s1
InChIInChI=1S/C26H25FN4O2S.C26H27N5O2S.C25H20F2N4O2S.C25H21FN6O2S.C25H23FN4O2S.C24H22FN5O2S.C23H16F4N4OS/c1-33-24-21(13-19(15-29-24)18-4-7-22-23(14-18)34-26(28)30-22)25(32)31-10-8-17(9-11-31)12-16-2-5-20(27)6-3-16;1-17-3-5-18(6-4-17)16-30-9-11-31(12-10-30)25(32)21-13-20(15-28-24(21)33-2)19-7-8-22-23(14-19)34-26(27)29-22;26-16-7-15(23(19(27)10-16)33-17-2-3-17)12-31-6-5-20-18(24(31)32)8-14(11-29-20)13-1-4-21-22(9-13)34-25(28)30-21;1-14(15-3-6-18(26)7-4-15)32-13-19(12-29-32)30-23(33)20-9-17(11-28-24(20)34-2)16-5-8-21-22(10-16)35-25(27)31-21;1-32-23-20(12-18(14-28-23)17-4-7-21-22(13-17)33-25(27)29-21)24(31)30-10-8-16(9-11-30)15-2-5-19(26)6-3-15;1-32-22-19(12-16(14-27-22)15-2-7-20-21(13-15)33-24(26)28-20)23(31)30-10-8-29(9-11-30)18-5-3-17(25)4-6-18;24-17-3-2-15(23(25,26)27)7-14(17)11-31-6-5-18-16(21(31)32)8-13(10-29-18)12-1-4-19-20(9-12)33-22(28)30-19/h2-7,13-15,17H,8-12H2,1H3,(H2,28,30);3-8,13-15H,9-12,16H2,1-2H3,(H2,27,29);1,4,7-11,17H,2-3,5-6,12H2,(H2,28,30);3-14H,1-2H3,(H2,27,31)(H,30,33);2-7,12-14,16H,8-11H2,1H3,(H2,27,29);2-7,12-14H,8-11H2,1H3,(H2,26,28);1-4,7-10H,5-6,11H2,(H2,28,30)
InChIKeyNKGNEQPUZSORNV-UHFFFAOYSA-N
XLogP33.96
TPSA593.24 Ų
H-Bond Donors8
H-Bond Acceptors45
Rotatable Bonds32
Heavy Atoms236
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003315.81
LogP ≤ 533.96
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1045

Analyze 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone with MolForge

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Launch Full Analysis

Related Compounds

N-[(3R)-1-(1-benzofuran-3-ylmethyl)piperidin-3-yl]-3-(2-methyl-1,3-benzothiazol-6-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;2-[(3S)-1-benzylpiperidin-3-yl]-1-[3-(2,3-dihydro-1-benzofuran-5-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]ethanone;2-[(1S,2S,5S)-8-[(2,6-difluorophenyl)methyl]-8-azabicyclo[3.2.1]octan-2-yl]-1-[3-(2-methyl-4-pyridinyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridin-5-yl]ethanone;2-[(3R)-1-[(2,6-difluorophenyl)methyl]-5,5-difluoropiperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridin-5-yl]ethanone;2-[(3S)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1-[3-(2,3-dihydro-1-benzofuran-5-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]ethanone
CID 158461708
N-[(3R)-1-(1-benzofuran-3-ylmethyl)piperidin-3-yl]-3-(2-methyl-1,3-benzothiazol-6-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;2-[(3S)-1-benzylpiperidin-3-yl]-1-[3-(2,3-dihydro-1-benzofuran-5-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]ethanone;2-[(3S)-1-benzylpiperidin-3-yl]-1-(3-pyridin-4-yl-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridin-5-yl)ethanone;2-[(1S,2S,5S)-8-[(2,6-difluorophenyl)methyl]-8-azabicyclo[3.2.1]octan-2-yl]-1-[3-(2-methyl-4-pyridinyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridin-5-yl]ethanone;2-[(3R)-1-[(2,6-difluorophenyl)methyl]-5,5-difluoropiperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridin-5-yl]ethanone;2-[(3S)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-1-[3-(2,3-dihydro-1-benzofuran-5-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]ethanone
CID 160255053
[4-[(2-Amino-1,3-benzothiazol-4-yl)sulfonylmethyl]phenyl]-[4-hydroxy-4-(3,3,3-trifluoropropyl)piperidin-1-yl]methanone;[4-[(2-amino-6-fluoro-1,3-benzothiazol-4-yl)sulfonylmethyl]phenyl]-[4-(3,3-difluorobutyl)-4-hydroxypiperidin-1-yl]methanone;[4-(1,3-benzothiazol-4-ylsulfonylmethyl)phenyl]-[4-[(2,2-difluorocyclopropyl)methyl]-4-hydroxypiperidin-1-yl]methanone;[4-(1,3-benzothiazol-4-ylsulfonylmethyl)phenyl]-[4-hydroxy-4-[(1-methylpyrazol-4-yl)methyl]piperidin-1-yl]methanone;[4-(1,3-benzothiazol-4-ylsulfonylmethyl)phenyl]-[4-hydroxy-4-[(2-methylpyrazol-3-yl)methyl]piperidin-1-yl]methanone;[4-(3,3-difluorobutyl)-4-hydroxypiperidin-1-yl]-[2-(difluoromethoxy)-4-(quinoxalin-5-ylsulfonylmethyl)phenyl]methanone;[4-[(4-hydroxy-1,4-dihydroquinazolin-8-yl)sulfonylmethyl]phenyl]-[4-hydroxy-4-(3,3,3-trifluoro-2-methylpropyl)piperidin-1-yl]methanone
CID 161926024
(2-amino-1,3-benzothiazol-6-yl)-[1'-(trifluoromethyl)spiro[piperidine-4,4'-pyrrolo[2,1-c][1,4]benzoxazine]-1-yl]methanone;(3-methyl-4-propan-2-yloxyphenyl)-(9-methylspiro[9bH-chromeno[4,3-b]pyrrole-4,4'-piperidine]-1'-yl)methanone;(3-methyl-4-propan-2-yloxyphenyl)-(1-methylspiro[chromeno[3,4-d]pyrazole-4,4'-piperidine]-1'-yl)methanone;(1-methylspiro[chromeno[3,4-d]pyrazole-4,4'-piperidine]-1'-yl)-[5-(trifluoromethoxy)-1H-indol-2-yl]methanone;molecular hydrogen
CID 162241105
5-(2-amino-1,3-benzothiazol-6-yl)-N-[[2-(cyclopropylmethoxy)-3,5-difluorophenyl]methyl]-2-methoxy-6-methylpyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-6-methyl-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;4-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[(2-cyclopentyloxy-5-fluorophenyl)methyl]-1-methylindazole-6-carboxamide;5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one;4-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[[2-fluoro-5-(trifluoromethoxy)phenyl]methyl]-1-methylindazole-6-carboxamide;[4-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-methylindazol-6-yl]-[3-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;4-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]-1H-indazole-6-carboxamide
CID 164971931
5-(2-acetamido-1,3-benzothiazol-6-yl)-2-methoxy-N-[(1S)-1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-[(1R)-1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-[(1S)-1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-[1-[3-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-[[3-(trifluoromethoxy)phenyl]methyl]pyridine-3-carboxamide
CID 164986989
5-(2-amino-1,3-benzothiazol-6-yl)-6-chloro-N-[[3-(trifluoromethoxy)phenyl]methyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[(2-cyclopentyloxy-5-fluorophenyl)methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[(2-cyclopentyloxy-6-fluorophenyl)methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[[2-(cyclopropylmethoxy)phenyl]methyl]pyridine-3-carboxamide;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone
CID 164988643
2-amino-5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;6-amino-5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[[3,5-difluoro-2-(2-methylpropoxy)phenyl]methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[2-fluoro-6-(trifluoromethoxy)phenyl]ethyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[2-fluoro-5-(trifluoromethoxy)phenyl]ethyl]-2-methylpyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-[(2-propan-2-yloxyphenyl)methyl]pyridine-3-carboxamide
CID 164993217
5-(2-amino-1,3-benzothiazol-6-yl)-N-[[2-(cyclopentylmethoxy)-6-fluorophenyl]methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[1-[2-fluoro-5-(trifluoromethoxy)phenyl]ethyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-[[2-(oxolan-3-yloxy)phenyl]methyl]pyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[1-[2-(trifluoromethoxy)phenyl]ethyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-[2-(cyclopropanecarbonylamino)-1,3-benzothiazol-6-yl]-2-methoxy-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide
CID 165019959
5-(2-amino-1,3-benzothiazol-6-yl)-N-[[2-(cyclopentylmethoxy)-6-fluorophenyl]methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[3,5-difluoro-2-(2-methylpropoxy)phenyl]ethyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[2-fluoro-6-(trifluoromethoxy)phenyl]ethyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-[[2-(oxolan-3-yloxy)phenyl]methyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-[(2-propan-2-yloxyphenyl)methyl]pyridine-3-carboxamide;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone
CID 165022800
5-(2-amino-1,3-benzothiazol-6-yl)-N-[(2-cyclopentyloxy-5-fluorophenyl)methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[(2-cyclopentyloxy-6-fluorophenyl)methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[[2-fluoro-5-(trifluoromethoxy)phenyl]methyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-N-(3-phenylpropyl)pyridine-3-carboxamide;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[(3R)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;4-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-methyl-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]indazole-6-carboxamide
CID 165033147
5-(2-acetamido-1,3-benzothiazol-6-yl)-2-methoxy-N-[(1R)-1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-6-chloro-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-6-methoxy-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-[2-(cyclopropanecarbonylamino)-1,3-benzothiazol-6-yl]-2-methoxy-N-[(1R)-1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;5-[2-(cyclopropanecarbonylamino)-1,3-benzothiazol-6-yl]-2-methoxy-N-[(1S)-1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide
CID 165037651

Frequently Asked Questions

What is the IUPAC name of 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone?
The IUPAC name of 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone (CID 165036141) is 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone.
What is the SMILES notation for 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone?
The canonical SMILES for 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone is COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCC(c2ccc(F)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCN(Cc2ccc(C)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1.COc1ncc(-c2ccc3nc(N)sc3c2)cc1C(=O)Nc1cnn(C(C)c2ccc(F)cc2)c1.Nc1nc2ccc(-c3cnc4c(c3)C(=O)N(Cc3cc(C(F)(F)F)ccc3F)CC4)cc2s1.Nc1nc2ccc(-c3cnc4c(c3)C(=O)N(Cc3cc(F)cc(F)c3OC3CC3)CC4)cc2s1.
What is the InChIKey of 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone?
The InChIKey is NKGNEQPUZSORNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25FN4O2S.C26H27N5O2S.C25H20F2N4O2S.C25H21FN6O2S.C25H23FN4O2S.C24H22FN5O2S.C23H16F4N4OS/c1-33-24-21(13-19(15-29-24)18-4-7-22-23(14-18)34-26(28)30-22)25(32)31-10-8-17(9-11-31)12-16-2-5-20(27)6-3-16;1-17-3-5-18(6-4-17)16-30-9-11-31(12-10-30)25(32)21-13-20(15-28-24(21)33-2)19-7-8-22-23(14-19)34-26(27)29-22;26-16-7-15(23(19(27)10-16)33-17-2-3-17)12-31-6-5-20-18(24(31)32)8-14(11-29-20)13-1-4-21-22(9-13)34-25(28)30-21;1-14(15-3-6-18(26)7-4-15)32-13-19(12-29-32)30-23(33)20-9-17(11-28-24(20)34-2)16-5-8-21-22(10-16)35-25(27)31-21;1-32-23-20(12-18(14-28-23)17-4-7-21-22(13-17)33-25(27)29-21)24(31)30-10-8-16(9-11-30)15-2-5-19(26)6-3-15;1-32-22-19(12-16(14-27-22)15-2-7-20-21(13-15)33-24(26)28-20)23(31)30-10-8-29(9-11-30)18-5-3-17(25)4-6-18;24-17-3-2-15(23(25,26)27)7-14(17)11-31-6-5-18-16(21(31)32)8-13(10-29-18)12-1-4-19-20(9-12)33-22(28)30-19/h2-7,13-15,17H,8-12H2,1H3,(H2,28,30);3-8,13-15H,9-12,16H2,1-2H3,(H2,27,29);1,4,7-11,17H,2-3,5-6,12H2,(H2,28,30);3-14H,1-2H3,(H2,27,31)(H,30,33);2-7,12-14,16H,8-11H2,1H3,(H2,27,29);2-7,12-14H,8-11H2,1H3,(H2,26,28);1-4,7-10H,5-6,11H2,(H2,28,30).
What are the key properties of 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone?
3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone has a molecular weight of 3315.81 g/mol, XLogP of 33.96, 32 rotatable bonds, 8 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-amino-1,3-benzothiazol-6-yl)-6-[(2-cyclopropyloxy-3,5-difluorophenyl)methyl]-7,8-dihydro-1,6-naphthyridin-5-one;5-(2-amino-1,3-benzothiazol-6-yl)-N-[1-[1-(4-fluorophenyl)ethyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide;3-(2-amino-1,3-benzothiazol-6-yl)-6-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7,8-dihydro-1,6-naphthyridin-5-one;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-(4-fluorophenyl)piperidin-1-yl]methanone;[5-(2-amino-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone is sourced from PubChem (CID 165036141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).