2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone

C138H159Br9Cl6N16O14+6 — CID 161141555

About 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone

2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone (PubChem CID 161141555) has the molecular formula C138H159Br9Cl6N16O14+6 and a molecular weight of 3197.74 g/mol. Its IUPAC name is 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone.

Molecular Properties

• Compound Name: 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone
• PubChem CID: 161141555
• Molecular Formula: C138H159Br9Cl6N16O14+6
• Molecular Weight: 3197.74 g/mol
• Exact Mass: 3184.30
• IUPAC Name: 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone
• SMILES: CC(=O)N1CCC(CC(=O)N2CCC(C3c4c(Br)cc(Br)cc4CCc4cc(Br)c[n+](O)c43)CC2)CC1.CC(=O)N1CCC(CC(=O)N2CCC([C@@H]3c4c(Br)cc(Cl)cc4CCc4cc(Br)c[n+](O)c43)CC2)CC1.CC(=O)N1CCC(CC(=O)N2CCC([C@H]3c4c(Br)cc(Cl)cc4CCc4cc(Br)c[n+](O)c43)CC2)CC1.CC(=O)N1CCC(CC(=O)N2CCN(C3c4c(Cl)cc(Cl)cc4CCc4cc(Br)c[n+](O)c43)CC2)CC1.C[n+]1ccc(CC(=O)N2CCC(C3c4c(Cl)cc(Cl)cc4CCc4cc(Br)c[n+](O)c43)CC2)cc1
• InChI: InChI=1S/C28H33Br3N3O3.2C28H33Br2ClN3O3.C27H32BrCl2N4O3.C27H28BrCl2N3O2/c1-17(35)32-8-4-18(5-9-32)12-25(36)33-10-6-19(7-11-33)27-26-20(13-22(29)15-24(26)31)2-3-21-14-23(30)16-34(37)28(21)27;2*1-17(35)32-8-4-18(5-9-32)12-25(36)33-10-6-19(7-11-33)27-26-20(14-23(31)15-24(26)30)2-3-21-13-22(29)16-34(37)28(21)27;1-17(35)31-6-4-18(5-7-31)12-24(36)32-8-10-33(11-9-32)27-25-19(14-22(29)15-23(25)30)2-3-20-13-21(28)16-34(37)26(20)27;1-31-8-4-17(5-9-31)12-24(34)32-10-6-18(7-11-32)26-25-19(14-22(29)15-23(25)30)2-3-20-13-21(28)16-33(35)27(20)26/h3*13-16,18-19,27,37H,2-12H2,1H3;13-16,18,27,37H,2-12H2,1H3;4-5,8-9,13-16,18,26,35H,2-3,6-7,10-12H2,1H3/q4*+1;+2/t;2*27-;;/m.10../s1
• InChIKey: UIYPUGLROBSQMV-FHDTUFDWSA-N
• XLogP: 25.71
• TPSA: 310.46 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 15
• Rotatable Bonds: 15
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3197.74
LogP ≤ 5	25.71
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}, {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone?

The IUPAC name of 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone (CID 161141555) is 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone.

What is the SMILES notation for 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone?

The canonical SMILES for 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone is CC(=O)N1CCC(CC(=O)N2CCC(C3c4c(Br)cc(Br)cc4CCc4cc(Br)c[n+](O)c43)CC2)CC1.CC(=O)N1CCC(CC(=O)N2CCC([C@@H]3c4c(Br)cc(Cl)cc4CCc4cc(Br)c[n+](O)c43)CC2)CC1.CC(=O)N1CCC(CC(=O)N2CCC([C@H]3c4c(Br)cc(Cl)cc4CCc4cc(Br)c[n+](O)c43)CC2)CC1.CC(=O)N1CCC(CC(=O)N2CCN(C3c4c(Cl)cc(Cl)cc4CCc4cc(Br)c[n+](O)c43)CC2)CC1.C[n+]1ccc(CC(=O)N2CCC(C3c4c(Cl)cc(Cl)cc4CCc4cc(Br)c[n+](O)c43)CC2)cc1.

What is the InChIKey of 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone?

The InChIKey is UIYPUGLROBSQMV-FHDTUFDWSA-N. The full InChI is InChI=1S/C28H33Br3N3O3.2C28H33Br2ClN3O3.C27H32BrCl2N4O3.C27H28BrCl2N3O2/c1-17(35)32-8-4-18(5-9-32)12-25(36)33-10-6-19(7-11-33)27-26-20(13-22(29)15-24(26)31)2-3-21-14-23(30)16-34(37)28(21)27;2*1-17(35)32-8-4-18(5-9-32)12-25(36)33-10-6-19(7-11-33)27-26-20(14-23(31)15-24(26)30)2-3-21-13-22(29)16-34(37)28(21)27;1-17(35)31-6-4-18(5-7-31)12-24(36)32-8-10-33(11-9-32)27-25-19(14-22(29)15-23(25)30)2-3-20-13-21(28)16-34(37)26(20)27;1-31-8-4-17(5-9-31)12-24(34)32-10-6-18(7-11-32)26-25-19(14-22(29)15-23(25)30)2-3-20-13-21(28)16-33(35)27(20)26/h3*13-16,18-19,27,37H,2-12H2,1H3;13-16,18,27,37H,2-12H2,1H3;4-5,8-9,13-16,18,26,35H,2-3,6-7,10-12H2,1H3/q4*+1;+2/t;2*27-;;/m.10../s1.

What are the key properties of 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone?

2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone has a molecular weight of 3197.74 g/mol, XLogP of 25.71, 15 rotatable bonds, 5 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(1-acetylpiperidin-4-yl)-1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperazin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2S)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-[(2R)-6,15-dibromo-13-chloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]ethanone;2-(1-acetylpiperidin-4-yl)-1-[4-(6,13,15-tribromo-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]ethanone;1-[4-(6-bromo-13,15-dichloro-4-hydroxy-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl)piperidin-1-yl]-2-(1-methylpyridin-1-ium-4-yl)ethanone is sourced from PubChem (CID 161141555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).