2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione

C143H181BrClF4N41O21S2 — CID 158309006

About 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione

2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione (PubChem CID 158309006) has the molecular formula C143H181BrClF4N41O21S2 and a molecular weight of 3065.77 g/mol. Its IUPAC name is 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione.

Molecular Properties

• Compound Name: 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione
• PubChem CID: 158309006
• Molecular Formula: C143H181BrClF4N41O21S2
• Molecular Weight: 3065.77 g/mol
• Exact Mass: 3062.26
• IUPAC Name: 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione
• SMILES: CS(=O)(=O)Cl.CS(=O)(=O)N1CCC(n2cc3c(n2)C(=O)NCCCCCCn2cc(cn2)-c2cccc(n2)C(=O)N3)CC1.O=C(O)C1CC1(F)F.O=C1Nc2cn(C3CCN(C(=O)C4CC4(F)F)CC3)nc2C(=O)NCCCCCCn2cc(cn2)-c2cccc1n2.O=C1Nc2cn(C3CCN(C(=O)CC4CC4)CC3)nc2C(=O)NCCCCCCn2cc(cn2)-c2cccc1n2.O=C1Nc2cn(C3CCN(CCO)CC3)nc2C(=O)NCCCCCCn2cc(cn2)-c2cccc1n2.O=C1Nc2cn(C3CCNCC3)nc2C(=O)NCCCCCCn2cc(cn2)-c2cccc1n2.O=C=NC1CC1.OCCBr
• InChI: InChI=1S/C29H36N8O3.C28H32F2N8O3.C26H34N8O3.C25H32N8O4S.C24H30N8O2.C4H4F2O2.C4H5NO.C2H5BrO.CH3ClO2S/c38-26(16-20-8-9-20)35-14-10-22(11-15-35)37-19-25-27(34-37)29(40)30-12-3-1-2-4-13-36-18-21(17-31-36)23-6-5-7-24(32-23)28(39)33-25;29-28(30)14-20(28)27(41)36-12-8-19(9-13-36)38-17-23-24(35-38)26(40)31-10-3-1-2-4-11-37-16-18(15-32-37)21-6-5-7-22(33-21)25(39)34-23;35-15-14-32-12-8-20(9-13-32)34-18-23-24(31-34)26(37)27-10-3-1-2-4-11-33-17-19(16-28-33)21-6-5-7-22(29-21)25(36)30-23;1-38(36,37)32-13-9-19(10-14-32)33-17-22-23(30-33)25(35)26-11-4-2-3-5-12-31-16-18(15-27-31)20-7-6-8-21(28-20)24(34)29-22;33-23-20-7-5-6-19(28-20)17-14-27-31(15-17)13-4-2-1-3-10-26-24(34)22-21(29-23)16-32(30-22)18-8-11-25-12-9-18;5-4(6)1-2(4)3(7)8;6-3-5-4-1-2-4;3-1-2-4;1-5(2,3)4/h5-7,17-20,22H,1-4,8-16H2,(H,30,40)(H,33,39);5-7,15-17,19-20H,1-4,8-14H2,(H,31,40)(H,34,39);5-7,16-18,20,35H,1-4,8-15H2,(H,27,37)(H,30,36);6-8,15-17,19H,2-5,9-14H2,1H3,(H,26,35)(H,29,34);5-7,14-16,18,25H,1-4,8-13H2,(H,26,34)(H,29,33);2H,1H2,(H,7,8);4H,1-2H2;4H,1-2H2;1H3
• InChIKey: GNLGKDMEKWEMEC-UHFFFAOYSA-N
• XLogP: 16.19
• TPSA: 768.25 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 48
• Rotatable Bonds: 14
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3065.77
LogP ≤ 5	16.19
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	48

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isocyanate', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione?

The IUPAC name of 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione (CID 158309006) is 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione.

What is the SMILES notation for 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione?

The canonical SMILES for 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione is CS(=O)(=O)Cl.CS(=O)(=O)N1CCC(n2cc3c(n2)C(=O)NCCCCCCn2cc(cn2)-c2cccc(n2)C(=O)N3)CC1.O=C(O)C1CC1(F)F.O=C1Nc2cn(C3CCN(C(=O)C4CC4(F)F)CC3)nc2C(=O)NCCCCCCn2cc(cn2)-c2cccc1n2.O=C1Nc2cn(C3CCN(C(=O)CC4CC4)CC3)nc2C(=O)NCCCCCCn2cc(cn2)-c2cccc1n2.O=C1Nc2cn(C3CCN(CCO)CC3)nc2C(=O)NCCCCCCn2cc(cn2)-c2cccc1n2.O=C1Nc2cn(C3CCNCC3)nc2C(=O)NCCCCCCn2cc(cn2)-c2cccc1n2.O=C=NC1CC1.OCCBr.

What is the InChIKey of 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione?

The InChIKey is GNLGKDMEKWEMEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H36N8O3.C28H32F2N8O3.C26H34N8O3.C25H32N8O4S.C24H30N8O2.C4H4F2O2.C4H5NO.C2H5BrO.CH3ClO2S/c38-26(16-20-8-9-20)35-14-10-22(11-15-35)37-19-25-27(34-37)29(40)30-12-3-1-2-4-13-36-18-21(17-31-36)23-6-5-7-24(32-23)28(39)33-25;29-28(30)14-20(28)27(41)36-12-8-19(9-13-36)38-17-23-24(35-38)26(40)31-10-3-1-2-4-11-37-16-18(15-32-37)21-6-5-7-22(33-21)25(39)34-23;35-15-14-32-12-8-20(9-13-32)34-18-23-24(31-34)26(37)27-10-3-1-2-4-11-33-17-19(16-28-33)21-6-5-7-22(29-21)25(36)30-23;1-38(36,37)32-13-9-19(10-14-32)33-17-22-23(30-33)25(35)26-11-4-2-3-5-12-31-16-18(15-27-31)20-7-6-8-21(28-20)24(34)29-22;33-23-20-7-5-6-19(28-20)17-14-27-31(15-17)13-4-2-1-3-10-26-24(34)22-21(29-23)16-32(30-22)18-8-11-25-12-9-18;5-4(6)1-2(4)3(7)8;6-3-5-4-1-2-4;3-1-2-4;1-5(2,3)4/h5-7,17-20,22H,1-4,8-16H2,(H,30,40)(H,33,39);5-7,15-17,19-20H,1-4,8-14H2,(H,31,40)(H,34,39);5-7,16-18,20,35H,1-4,8-15H2,(H,27,37)(H,30,36);6-8,15-17,19H,2-5,9-14H2,1H3,(H,26,35)(H,29,34);5-7,14-16,18,25H,1-4,8-13H2,(H,26,34)(H,29,33);2H,1H2,(H,7,8);4H,1-2H2;4H,1-2H2;1H3.

What are the key properties of 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione?

2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione has a molecular weight of 3065.77 g/mol, XLogP of 16.19, 14 rotatable bonds, 14 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromoethanol;16-[1-(2-cyclopropylacetyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-[1-(2,2-difluorocyclopropanecarbonyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;2,2-difluorocyclopropane-1-carboxylic acid;16-[1-(2-hydroxyethyl)piperidin-4-yl]-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;isocyanatocyclopropane;methanesulfonyl chloride;16-(1-methylsulfonylpiperidin-4-yl)-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione;16-piperidin-4-yl-4,5,12,15,16,19,25-heptazatetracyclo[19.3.1.12,5.014,18]hexacosa-1(25),2(26),3,14,17,21,23-heptaene-13,20-dione is sourced from PubChem (CID 158309006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).