2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole

C175H218ClN31O26S18 — CID 158243915

About 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole

2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole (PubChem CID 158243915) has the molecular formula C175H218ClN31O26S18 and a molecular weight of 3784.52 g/mol. Its IUPAC name is 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole.

Molecular Properties

• Compound Name: 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole
• PubChem CID: 158243915
• Molecular Formula: C175H218ClN31O26S18
• Molecular Weight: 3784.52 g/mol
• Exact Mass: 3780.14
• IUPAC Name: 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole
• SMILES: C=C(OCC1=Cc2ccccc2S1(=O)=O)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.C=C(c1csnn1)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.C=S(C)(=O)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncc(Cl)cn5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5nnc(C)s5)CC4)sc3c2)CC1.CCCc1cnc(N2CC(COc3nc4ccc(C5=CCN(S(C)(=O)=O)CC5)cc4s3)C2)nc1.CCCc1cnc(N2CCC(Oc3nc4ccc(C5CCN(S(=O)(=O)CCCO)CC5)cc4s3)CC2)nc1
• InChI: InChI=1S/C31H35N3O6S3.C27H37N5O4S2.C24H28ClN5O3S2.C24H29N5O3S3.C24H29N5O3S2.C23H29N5O3S3.C22H31N3O4S3/c1-3-18-42(35,36)34-16-10-23(11-17-34)24-8-9-28-29(20-24)41-31(32-28)40-26-12-14-33(15-13-26)22(2)39-21-27-19-25-6-4-5-7-30(25)43(27,37)38;1-2-4-20-18-28-26(29-19-20)31-11-9-23(10-12-31)36-27-30-24-6-5-22(17-25(24)37-27)21-7-13-32(14-8-21)38(34,35)16-3-15-33;1-2-13-35(31,32)30-11-5-17(6-12-30)18-3-4-21-22(14-18)34-24(28-21)33-20-7-9-29(10-8-20)23-26-15-19(25)16-27-23;1-3-14-35(30,31)29-12-6-18(7-13-29)19-4-5-21-23(15-19)34-24(25-21)32-20-8-10-28(11-9-20)17(2)22-16-33-27-26-22;1-3-4-17-12-25-23(26-13-17)28-14-18(15-28)16-32-24-27-21-6-5-20(11-22(21)33-24)19-7-9-29(10-8-19)34(2,30)31;1-3-14-34(29,30)28-12-6-17(7-13-28)18-4-5-20-21(15-18)33-23(24-20)31-19-8-10-27(11-9-19)22-26-25-16(2)32-22;1-4-15-32(27,28)25-11-7-17(8-12-25)18-5-6-20-21(16-18)30-22(23-20)29-19-9-13-24(14-10-19)31(2,3)26/h4-10,19-20,26H,2-3,11-18,21H2,1H3;5-6,17-19,21,23,33H,2-4,7-16H2,1H3;3-5,14-16,20H,2,6-13H2,1H3;4-6,15-16,20H,2-3,7-14H2,1H3;5-7,11-13,18H,3-4,8-10,14-16H2,1-2H3;4-6,15,19H,3,7-14H2,1-2H3;5-7,16,19H,2,4,8-15H2,1,3H3
• InChIKey: GFWSMQWDHVXBOK-UHFFFAOYSA-N
• XLogP: 29.54
• TPSA: 648.75 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 58
• Rotatable Bonds: 57
• Heavy Atoms: 251
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3784.52
LogP ≤ 5	29.54
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	58

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole?

The IUPAC name of 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole (CID 158243915) is 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole.

What is the SMILES notation for 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole?

The canonical SMILES for 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole is C=C(OCC1=Cc2ccccc2S1(=O)=O)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.C=C(c1csnn1)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.C=S(C)(=O)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncc(Cl)cn5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5nnc(C)s5)CC4)sc3c2)CC1.CCCc1cnc(N2CC(COc3nc4ccc(C5=CCN(S(C)(=O)=O)CC5)cc4s3)C2)nc1.CCCc1cnc(N2CCC(Oc3nc4ccc(C5CCN(S(=O)(=O)CCCO)CC5)cc4s3)CC2)nc1.

What is the InChIKey of 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole?

The InChIKey is GFWSMQWDHVXBOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H35N3O6S3.C27H37N5O4S2.C24H28ClN5O3S2.C24H29N5O3S3.C24H29N5O3S2.C23H29N5O3S3.C22H31N3O4S3/c1-3-18-42(35,36)34-16-10-23(11-17-34)24-8-9-28-29(20-24)41-31(32-28)40-26-12-14-33(15-13-26)22(2)39-21-27-19-25-6-4-5-7-30(25)43(27,37)38;1-2-4-20-18-28-26(29-19-20)31-11-9-23(10-12-31)36-27-30-24-6-5-22(17-25(24)37-27)21-7-13-32(14-8-21)38(34,35)16-3-15-33;1-2-13-35(31,32)30-11-5-17(6-12-30)18-3-4-21-22(14-18)34-24(28-21)33-20-7-9-29(10-8-20)23-26-15-19(25)16-27-23;1-3-14-35(30,31)29-12-6-18(7-13-29)19-4-5-21-23(15-19)34-24(25-21)32-20-8-10-28(11-9-20)17(2)22-16-33-27-26-22;1-3-4-17-12-25-23(26-13-17)28-14-18(15-28)16-32-24-27-21-6-5-20(11-22(21)33-24)19-7-9-29(10-8-19)34(2,30)31;1-3-14-34(29,30)28-12-6-17(7-13-28)18-4-5-20-21(15-18)33-23(24-20)31-19-8-10-27(11-9-19)22-26-25-16(2)32-22;1-4-15-32(27,28)25-11-7-17(8-12-25)18-5-6-20-21(16-18)30-22(23-20)29-19-9-13-24(14-10-19)31(2,3)26/h4-10,19-20,26H,2-3,11-18,21H2,1H3;5-6,17-19,21,23,33H,2-4,7-16H2,1H3;3-5,14-16,20H,2,6-13H2,1H3;4-6,15-16,20H,2-3,7-14H2,1H3;5-7,11-13,18H,3-4,8-10,14-16H2,1-2H3;4-6,15,19H,3,7-14H2,1-2H3;5-7,16,19H,2,4,8-15H2,1,3H3.

What are the key properties of 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole?

2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole has a molecular weight of 3784.52 g/mol, XLogP of 29.54, 57 rotatable bonds, 1 hydrogen bond donors, and 58 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;methyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[[1-(5-propylpyrimidin-2-yl)azetidin-3-yl]methoxy]-1,3-benzothiazole;2-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;3-[4-[2-[1-(5-propylpyrimidin-2-yl)piperidin-4-yl]oxy-1,3-benzothiazol-6-yl]piperidin-1-yl]sulfonylpropan-1-ol;2-[1-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]ethenoxymethyl]-1-benzothiophene 1,1-dioxide;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-[1-[1-(thiadiazol-4-yl)ethenyl]piperidin-4-yl]oxy-1,3-benzothiazole is sourced from PubChem (CID 158243915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).