butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole

C181H235F2N31O23S15 — CID 159242779

About butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole

butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole (PubChem CID 159242779) has the molecular formula C181H235F2N31O23S15 and a molecular weight of 3732.07 g/mol. Its IUPAC name is butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole.

Molecular Properties

• Compound Name: butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole
• PubChem CID: 159242779
• Molecular Formula: C181H235F2N31O23S15
• Molecular Weight: 3732.07 g/mol
• Exact Mass: 3728.40
• IUPAC Name: butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole
• SMILES: C=C(OCC(C)(C)C)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.C=S(=O)(CCCC)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5nc(C)cc(C)n5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncc(C(C)(F)F)cn5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncc(C6CC6)cn5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncc(CC)cn5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncccn5)CC4)sc3c2)CC1
• InChI: InChI=1S/C27H33N5O3S2.C27H39N3O4S2.C26H31F2N5O3S2.2C26H33N5O3S2.C25H37N3O4S3.C24H29N5O3S2/c1-2-15-37(33,34)32-13-7-20(8-14-32)21-5-6-24-25(16-21)36-27(30-24)35-23-9-11-31(12-10-23)26-28-17-22(18-29-26)19-3-4-19;1-6-17-36(31,32)30-15-9-21(10-16-30)22-7-8-24-25(18-22)35-26(28-24)34-23-11-13-29(14-12-23)20(2)33-19-27(3,4)5;1-3-14-38(34,35)33-12-6-18(7-13-33)19-4-5-22-23(15-19)37-25(31-22)36-21-8-10-32(11-9-21)24-29-16-20(17-30-24)26(2,27)28;1-4-15-36(32,33)31-13-7-20(8-14-31)21-5-6-23-24(17-21)35-26(29-23)34-22-9-11-30(12-10-22)25-27-18(2)16-19(3)28-25;1-3-15-36(32,33)31-13-7-20(8-14-31)21-5-6-23-24(16-21)35-26(29-23)34-22-9-11-30(12-10-22)25-27-17-19(4-2)18-28-25;1-4-6-18-34(3,29)27-15-11-22(12-16-27)32-25-26-23-8-7-21(19-24(23)33-25)20-9-13-28(14-10-20)35(30,31)17-5-2;1-2-16-34(30,31)29-14-6-18(7-15-29)19-4-5-21-22(17-19)33-24(27-21)32-20-8-12-28(13-9-20)23-25-10-3-11-26-23/h5-7,16-19,23H,2-4,8-15H2,1H3;7-9,18,23H,2,6,10-17,19H2,1,3-5H3;4-6,15-17,21H,3,7-14H2,1-2H3;5-7,16-17,22H,4,8-15H2,1-3H3;5-7,16-18,22H,3-4,8-15H2,1-2H3;7-9,19,22H,3-6,10-18H2,1-2H3;3-6,10-11,17,20H,2,7-9,12-16H2,1H3
• InChIKey: KUHMNLROISQIHJ-UHFFFAOYSA-N
• XLogP: 32.89
• TPSA: 594.38 Ų
• H-Bond Acceptors: 53
• Rotatable Bonds: 57
• Heavy Atoms: 252
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3732.07
LogP ≤ 5	32.89
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	53

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 butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole?

The IUPAC name of butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole (CID 159242779) is butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole.

What is the SMILES notation for butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole?

The canonical SMILES for butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole is C=C(OCC(C)(C)C)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.C=S(=O)(CCCC)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5nc(C)cc(C)n5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncc(C(C)(F)F)cn5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncc(C6CC6)cn5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncc(CC)cn5)CC4)sc3c2)CC1.CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(c5ncccn5)CC4)sc3c2)CC1.

What is the InChIKey of butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole?

The InChIKey is KUHMNLROISQIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N5O3S2.C27H39N3O4S2.C26H31F2N5O3S2.2C26H33N5O3S2.C25H37N3O4S3.C24H29N5O3S2/c1-2-15-37(33,34)32-13-7-20(8-14-32)21-5-6-24-25(16-21)36-27(30-24)35-23-9-11-31(12-10-23)26-28-17-22(18-29-26)19-3-4-19;1-6-17-36(31,32)30-15-9-21(10-16-30)22-7-8-24-25(18-22)35-26(28-24)34-23-11-13-29(14-12-23)20(2)33-19-27(3,4)5;1-3-14-38(34,35)33-12-6-18(7-13-33)19-4-5-22-23(15-19)37-25(31-22)36-21-8-10-32(11-9-21)24-29-16-20(17-30-24)26(2,27)28;1-4-15-36(32,33)31-13-7-20(8-14-31)21-5-6-23-24(17-21)35-26(29-23)34-22-9-11-30(12-10-22)25-27-18(2)16-19(3)28-25;1-3-15-36(32,33)31-13-7-20(8-14-31)21-5-6-23-24(16-21)35-26(29-23)34-22-9-11-30(12-10-22)25-27-17-19(4-2)18-28-25;1-4-6-18-34(3,29)27-15-11-22(12-16-27)32-25-26-23-8-7-21(19-24(23)33-25)20-9-13-28(14-10-20)35(30,31)17-5-2;1-2-16-34(30,31)29-14-6-18(7-15-29)19-4-5-21-22(17-19)33-24(27-21)32-20-8-12-28(13-9-20)23-25-10-3-11-26-23/h5-7,16-19,23H,2-4,8-15H2,1H3;7-9,18,23H,2,6,10-17,19H2,1,3-5H3;4-6,15-17,21H,3,7-14H2,1-2H3;5-7,16-17,22H,4,8-15H2,1-3H3;5-7,16-18,22H,3-4,8-15H2,1-2H3;7-9,19,22H,3-6,10-18H2,1-2H3;3-6,10-11,17,20H,2,7-9,12-16H2,1H3.

What are the key properties of butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole?

butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole has a molecular weight of 3732.07 g/mol, XLogP of 32.89, 57 rotatable bonds, 0 hydrogen bond donors, and 53 hydrogen bond acceptors.

Where does this data come from?

All data for butyl-methylidene-oxo-[4-[[6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazol-2-yl]oxy]piperidin-1-yl]-λ6-sulfane;2-[1-(5-cyclopropylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-[1-(2,2-dimethylpropoxy)ethenyl]piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-1,3-benzothiazole;6-(1-propylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)oxy-1,3-benzothiazole is sourced from PubChem (CID 159242779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).