2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone

C195H200F8N34O15S3 — CID 165024930

IUPAC2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone
SMILESCC1CN(c2nc3ncccc3o2)CCN1C(=O)Cc1ccc(C2CC2)c(F)c1.CC1CN(c2nc3ncccc3o2)CCN1C(=O)Cc1ccc(C2CC2)cc1.Cc1ccc2nc(N3CCN(C(=O)Cc4ccc(C5CC5)c(F)c4)CC3)sc2c1.Cc1cnc2nc(N3CCN(C(=O)Cc4ccc(C5CC5)cc4)CC3)oc2c1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3c(F)cccc3s2)CC1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3cccnc3o2)CC1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3ncccc3o2)CC1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3ncccc3s2)CC1.O=C(Cc1ccc(C2CC2)cc1)N1CCN(c2nc3nccc(F)c3o2)CC1
InChIInChI=1S/C23H24FN3OS.C22H21F2N3OS.C22H23FN4O2.2C22H24N4O2.3C21H21FN4O2.C21H21FN4OS/c1-15-2-7-20-21(12-15)29-23(25-20)27-10-8-26(9-11-27)22(28)14-16-3-6-18(17-4-5-17)19(24)13-16;23-17-2-1-3-19-21(17)25-22(29-19)27-10-8-26(9-11-27)20(28)13-14-4-7-16(15-5-6-15)18(24)12-14;1-14-13-26(22-25-21-19(29-22)3-2-8-24-21)9-10-27(14)20(28)12-15-4-7-17(16-5-6-16)18(23)11-15;1-15-12-19-21(23-14-15)24-22(28-19)26-10-8-25(9-11-26)20(27)13-16-2-4-17(5-3-16)18-6-7-18;1-15-14-25(22-24-21-19(28-22)3-2-10-23-21)11-12-26(15)20(27)13-16-4-6-17(7-5-16)18-8-9-18;22-17-7-8-23-20-19(17)28-21(24-20)26-11-9-25(10-12-26)18(27)13-14-1-3-15(4-2-14)16-5-6-16;22-17-12-14(3-6-16(17)15-4-5-15)13-19(27)25-8-10-26(11-9-25)21-24-20-18(28-21)2-1-7-23-20;22-17-12-14(3-6-16(17)15-4-5-15)13-19(27)25-8-10-26(11-9-25)21-24-18-2-1-7-23-20(18)28-21;22-17-12-14(3-6-16(17)15-4-5-15)13-19(27)25-8-10-26(11-9-25)21-24-20-18(28-21)2-1-7-23-20/h2-3,6-7,12-13,17H,4-5,8-11,14H2,1H3;1-4,7,12,15H,5-6,8-11,13H2;2-4,7-8,11,14,16H,5-6,9-10,12-13H2,1H3;2-5,12,14,18H,6-11,13H2,1H3;2-7,10,15,18H,8-9,11-14H2,1H3;1-4,7-8,16H,5-6,9-13H2;3*1-3,6-7,12,15H,4-5,8-11,13H2
InChIKeyLSPKPRKWEASSAU-UHFFFAOYSA-N
MW3508.15 g/mol
LogP32.05
Rot. Bonds36

About 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone

2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone (PubChem CID 165024930) has the molecular formula C195H200F8N34O15S3 and a molecular weight of 3508.15 g/mol. Its IUPAC name is 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone
PubChem CID165024930
Molecular FormulaC195H200F8N34O15S3
Molecular Weight3508.15 g/mol
Exact Mass3505.50
IUPAC Name2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone
SMILESCC1CN(c2nc3ncccc3o2)CCN1C(=O)Cc1ccc(C2CC2)c(F)c1.CC1CN(c2nc3ncccc3o2)CCN1C(=O)Cc1ccc(C2CC2)cc1.Cc1ccc2nc(N3CCN(C(=O)Cc4ccc(C5CC5)c(F)c4)CC3)sc2c1.Cc1cnc2nc(N3CCN(C(=O)Cc4ccc(C5CC5)cc4)CC3)oc2c1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3c(F)cccc3s2)CC1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3cccnc3o2)CC1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3ncccc3o2)CC1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3ncccc3s2)CC1.O=C(Cc1ccc(C2CC2)cc1)N1CCN(c2nc3nccc(F)c3o2)CC1
InChIInChI=1S/C23H24FN3OS.C22H21F2N3OS.C22H23FN4O2.2C22H24N4O2.3C21H21FN4O2.C21H21FN4OS/c1-15-2-7-20-21(12-15)29-23(25-20)27-10-8-26(9-11-27)22(28)14-16-3-6-18(17-4-5-17)19(24)13-16;23-17-2-1-3-19-21(17)25-22(29-19)27-10-8-26(9-11-27)20(28)13-14-4-7-16(15-5-6-15)18(24)12-14;1-14-13-26(22-25-21-19(29-22)3-2-8-24-21)9-10-27(14)20(28)12-15-4-7-17(16-5-6-16)18(23)11-15;1-15-12-19-21(23-14-15)24-22(28-19)26-10-8-25(9-11-26)20(27)13-16-2-4-17(5-3-16)18-6-7-18;1-15-14-25(22-24-21-19(28-22)3-2-10-23-21)11-12-26(15)20(27)13-16-4-6-17(7-5-16)18-8-9-18;22-17-7-8-23-20-19(17)28-21(24-20)26-11-9-25(10-12-26)18(27)13-14-1-3-15(4-2-14)16-5-6-16;22-17-12-14(3-6-16(17)15-4-5-15)13-19(27)25-8-10-26(11-9-25)21-24-20-18(28-21)2-1-7-23-20;22-17-12-14(3-6-16(17)15-4-5-15)13-19(27)25-8-10-26(11-9-25)21-24-18-2-1-7-23-20(18)28-21;22-17-12-14(3-6-16(17)15-4-5-15)13-19(27)25-8-10-26(11-9-25)21-24-20-18(28-21)2-1-7-23-20/h2-3,6-7,12-13,17H,4-5,8-11,14H2,1H3;1-4,7,12,15H,5-6,8-11,13H2;2-4,7-8,11,14,16H,5-6,9-10,12-13H2,1H3;2-5,12,14,18H,6-11,13H2,1H3;2-7,10,15,18H,8-9,11-14H2,1H3;1-4,7-8,16H,5-6,9-13H2;3*1-3,6-7,12,15H,4-5,8-11,13H2
InChIKeyLSPKPRKWEASSAU-UHFFFAOYSA-N
XLogP32.05
TPSA497.03 Ų
H-Bond Donors
H-Bond Acceptors43
Rotatable Bonds36
Heavy Atoms255
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003508.15
LogP ≤ 532.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1043

Analyze 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone with MolForge

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Related Compounds

1H-benzimidazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1,3-benzothiazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1,3-benzoxazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-imidazo[4,5-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-pyrrol-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 158306259
6-[4-(1,1-Difluoroethoxy)phenyl]-1-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-methoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-phenoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-benzothiazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-oxazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-thiazole
CID 160025166
6-[4-(1,1-Difluoroethyl)phenyl]-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]oxazolo[4,5-b]pyridine;6-(3-methoxyphenyl)-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine;6-(5-methoxy-3-pyridinyl)-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine;6-(6-methyl-3-pyridinyl)-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]oxazolo[4,5-b]pyridine
CID 160452713
6-ethenyl-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]oxazolo[4,5-b]pyridine;6-(6-ethenyl-2-pyridinyl)-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]oxazolo[4,5-b]pyridine;N-[(4-methoxyphenyl)methyl]-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-c]pyridin-6-amine;6-methyl-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-c]pyridine;2-(4-piperidin-1-ylpiperidin-1-yl)-6-[6-(trifluoromethyl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine
CID 160676374
2-[(3R)-5,5-difluoro-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-[3-[(2,6-difluorophenyl)methyl]-3-azabicyclo[4.1.0]heptan-1-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-[(3R)-1-[(2,6-difluorophenyl)methyl]-5,5-difluoropiperidin-3-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-[(3S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-methylpiperidin-3-yl]-1-[3-(2-methyl-1,3-benzothiazol-6-yl)-1H-isoindol-5-yl]ethanone
CID 161234764
2-(4-cyclopropylphenyl)-1-[4-[6-(1,1-difluoroethyl)pyridazin-3-yl]piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;N-[4-[2-[4-[6-(1,1-difluoroethyl)pyridazin-3-yl]piperazin-1-yl]-2-oxoethyl]phenyl]methanesulfonamide;2-[4-(dimethylamino)phenyl]-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;bis(2-[4-(dimethylamino)phenyl]-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone);2-[4-(dimethylamino)phenyl]-1-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;N-[4-[2-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]-2-oxoethyl]phenyl]methanesulfonamide;N-[4-[2-oxo-2-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethyl]phenyl]methanesulfonamide;N-[4-[2-oxo-2-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethyl]phenyl]methanesulfonamide
CID 165000536
1-[4-(1,3-Benzothiazol-2-yl)-2-methylpiperazin-1-yl]-2-(4-cyclopropylphenyl)ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-[6-(1,1-difluoroethyl)pyridazin-3-yl]piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(5-ethynylpyrazin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-[6-(1,1-difluoroethyl)pyridazin-3-yl]-2-methylpiperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(5-ethynylpyrazin-2-yl)-2-methylpiperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylpiperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone
CID 165069485
2-[6-(1,3-Benzothiazol-2-yl)-3,8-bis(9,9-dimethylacridin-10-yl)phenanthren-1-yl]-1,3-benzothiazole;2-[6-(1,3-benzoxazol-2-yl)-3,8-bis(9,9-dimethylacridin-10-yl)phenanthren-1-yl]-1,3-benzoxazole;2-[1,6-bis(9,9-dimethylacridin-10-yl)-8-([1,3]oxazolo[5,4-b]pyridin-2-yl)phenanthren-3-yl]-[1,3]oxazolo[5,4-b]pyridine;10-[6-(9,9-dimethylacridin-10-yl)-3,8-bis(1-phenylbenzimidazol-2-yl)phenanthren-1-yl]-9,9-dimethylacridine
CID 157063066
CID 157176278
CID 157176278
Benzenethiolate;carbazol-9-ide;di(propan-2-yl)azanide;2-[3-[1-methyl-5-(4-phenylphenyl)imidazol-2-yl]benzene-2-id-1-yl]oxypyridine;tris(palladium(2+));5-(4-phenylphenyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1,3-oxazole;5-(4-phenylphenyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1,3-thiazole
CID 157178612
2,3-Dimethylimidazo[1,2-a]pyridine;bis(2,3-dimethylimidazo[4,5-b]pyridine);ethane;2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methyl-[1,3]oxazolo[4,5-b]pyridine;2-methyl-[1,3]thiazolo[4,5-b]pyridine
CID 157360441
2,5-Dimethyl-1,3-benzothiazole;2,5-dimethyl-1,3-benzoxazole;2,5-dimethyl-[1,3]oxazolo[4,5-b]pyridine;2,5-dimethyl-[1,3]thiazolo[4,5-b]pyridine;ethane;7-methylimidazo[1,2-a]pyridine;7-methylimidazo[1,2-a]pyrimidine;1,2,5-trimethylbenzimidazole;2,3,6-trimethylimidazo[4,5-b]pyridine
CID 157474605

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone?
The IUPAC name of 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone (CID 165024930) is 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone.
What is the SMILES notation for 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone?
The canonical SMILES for 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone is CC1CN(c2nc3ncccc3o2)CCN1C(=O)Cc1ccc(C2CC2)c(F)c1.CC1CN(c2nc3ncccc3o2)CCN1C(=O)Cc1ccc(C2CC2)cc1.Cc1ccc2nc(N3CCN(C(=O)Cc4ccc(C5CC5)c(F)c4)CC3)sc2c1.Cc1cnc2nc(N3CCN(C(=O)Cc4ccc(C5CC5)cc4)CC3)oc2c1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3c(F)cccc3s2)CC1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3cccnc3o2)CC1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3ncccc3o2)CC1.O=C(Cc1ccc(C2CC2)c(F)c1)N1CCN(c2nc3ncccc3s2)CC1.O=C(Cc1ccc(C2CC2)cc1)N1CCN(c2nc3nccc(F)c3o2)CC1.
What is the InChIKey of 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone?
The InChIKey is LSPKPRKWEASSAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN3OS.C22H21F2N3OS.C22H23FN4O2.2C22H24N4O2.3C21H21FN4O2.C21H21FN4OS/c1-15-2-7-20-21(12-15)29-23(25-20)27-10-8-26(9-11-27)22(28)14-16-3-6-18(17-4-5-17)19(24)13-16;23-17-2-1-3-19-21(17)25-22(29-19)27-10-8-26(9-11-27)20(28)13-14-4-7-16(15-5-6-15)18(24)12-14;1-14-13-26(22-25-21-19(29-22)3-2-8-24-21)9-10-27(14)20(28)12-15-4-7-17(16-5-6-16)18(23)11-15;1-15-12-19-21(23-14-15)24-22(28-19)26-10-8-25(9-11-26)20(27)13-16-2-4-17(5-3-16)18-6-7-18;1-15-14-25(22-24-21-19(28-22)3-2-10-23-21)11-12-26(15)20(27)13-16-4-6-17(7-5-16)18-8-9-18;22-17-7-8-23-20-19(17)28-21(24-20)26-11-9-25(10-12-26)18(27)13-14-1-3-15(4-2-14)16-5-6-16;22-17-12-14(3-6-16(17)15-4-5-15)13-19(27)25-8-10-26(11-9-25)21-24-20-18(28-21)2-1-7-23-20;22-17-12-14(3-6-16(17)15-4-5-15)13-19(27)25-8-10-26(11-9-25)21-24-18-2-1-7-23-20(18)28-21;22-17-12-14(3-6-16(17)15-4-5-15)13-19(27)25-8-10-26(11-9-25)21-24-20-18(28-21)2-1-7-23-20/h2-3,6-7,12-13,17H,4-5,8-11,14H2,1H3;1-4,7,12,15H,5-6,8-11,13H2;2-4,7-8,11,14,16H,5-6,9-10,12-13H2,1H3;2-5,12,14,18H,6-11,13H2,1H3;2-7,10,15,18H,8-9,11-14H2,1H3;1-4,7-8,16H,5-6,9-13H2;3*1-3,6-7,12,15H,4-5,8-11,13H2.
What are the key properties of 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone?
2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone has a molecular weight of 3508.15 g/mol, XLogP of 32.05, 36 rotatable bonds, 0 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(4-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropyl-3-fluorophenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(7-fluoro-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone;2-(4-cyclopropylphenyl)-1-[4-(6-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone is sourced from PubChem (CID 165024930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).