1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone

C190H174N20O14S6 — CID 159442419

IUPAC1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone
SMILESCC1CCN(c2ccc(C(=O)Cc3ccc4c(cnn4-c4ccc(CC(=O)c5cccs5)cc4)c3)cc2)C1.CC1CCN(c2ccc(C(=O)Cc3ccc4c(cnn4-c4ccc(CC(=O)c5cccs5)cc4)c3)cc2)CC1.CN(CCO)c1ccc(C(=O)Cc2ccc(-n3ncc4cc(CC(=O)c5cccs5)ccc43)cc2)cc1.Cc1ncsc1C(=O)Cc1ccc(-n2ncc3cc(CC(=O)c4ccc(N5CCCCC5)cc4)ccc32)cc1.O=C(Cc1ccc(-n2ncc3cc(CC(=O)c4cccs4)ccc32)cc1)c1ccc(N2CCC(O)CC2)cc1.O=C(Cc1ccc2c(cnn2-c2ccc(CC(=O)c3cncs3)cc2)c1)c1ccc(N2CCCCC2)cc1
InChIInChI=1S/C33H31N3O2S.C32H30N4O2S.C32H29N3O3S.C32H29N3O2S.C31H28N4O2S.C30H27N3O3S/c1-23-14-16-35(17-15-23)28-11-7-26(8-12-28)31(37)21-25-6-13-30-27(19-25)22-34-36(30)29-9-4-24(5-10-29)20-32(38)33-3-2-18-39-33;1-22-32(39-21-33-22)31(38)18-23-5-10-28(11-6-23)36-29-14-7-24(17-26(29)20-34-36)19-30(37)25-8-12-27(13-9-25)35-15-3-2-4-16-35;36-28-13-15-34(16-14-28)26-10-6-24(7-11-26)30(37)19-22-3-8-27(9-4-22)35-29-12-5-23(18-25(29)21-33-35)20-31(38)32-2-1-17-39-32;1-22-14-15-34(21-22)27-11-7-25(8-12-27)30(36)19-24-6-13-29-26(17-24)20-33-35(29)28-9-4-23(5-10-28)18-31(37)32-3-2-16-38-32;36-29(24-7-11-26(12-8-24)34-14-2-1-3-15-34)18-23-6-13-28-25(16-23)19-33-35(28)27-9-4-22(5-10-27)17-30(37)31-20-32-21-38-31;1-32(14-15-34)25-11-7-23(8-12-25)28(35)18-21-4-9-26(10-5-21)33-27-13-6-22(17-24(27)20-31-33)19-29(36)30-3-2-16-37-30/h2-13,18-19,22-23H,14-17,20-21H2,1H3;5-14,17,20-21H,2-4,15-16,18-19H2,1H3;1-12,17-18,21,28,36H,13-16,19-20H2;2-13,16-17,20,22H,14-15,18-19,21H2,1H3;4-13,16,19-21H,1-3,14-15,17-18H2;2-13,16-17,20,34H,14-15,18-19H2,1H3
InChIKeyLSIJGTLIPCJMGM-UHFFFAOYSA-N
MW3154.01 g/mol
LogP38.18
Rot. Bonds50

About 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone

1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone (PubChem CID 159442419) has the molecular formula C190H174N20O14S6 and a molecular weight of 3154.01 g/mol. Its IUPAC name is 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone.

Molecular Properties

Compound Name1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone
PubChem CID159442419
Molecular FormulaC190H174N20O14S6
Molecular Weight3154.01 g/mol
Exact Mass3151.18
IUPAC Name1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone
SMILESCC1CCN(c2ccc(C(=O)Cc3ccc4c(cnn4-c4ccc(CC(=O)c5cccs5)cc4)c3)cc2)C1.CC1CCN(c2ccc(C(=O)Cc3ccc4c(cnn4-c4ccc(CC(=O)c5cccs5)cc4)c3)cc2)CC1.CN(CCO)c1ccc(C(=O)Cc2ccc(-n3ncc4cc(CC(=O)c5cccs5)ccc43)cc2)cc1.Cc1ncsc1C(=O)Cc1ccc(-n2ncc3cc(CC(=O)c4ccc(N5CCCCC5)cc4)ccc32)cc1.O=C(Cc1ccc(-n2ncc3cc(CC(=O)c4cccs4)ccc32)cc1)c1ccc(N2CCC(O)CC2)cc1.O=C(Cc1ccc2c(cnn2-c2ccc(CC(=O)c3cncs3)cc2)c1)c1ccc(N2CCCCC2)cc1
InChIInChI=1S/C33H31N3O2S.C32H30N4O2S.C32H29N3O3S.C32H29N3O2S.C31H28N4O2S.C30H27N3O3S/c1-23-14-16-35(17-15-23)28-11-7-26(8-12-28)31(37)21-25-6-13-30-27(19-25)22-34-36(30)29-9-4-24(5-10-29)20-32(38)33-3-2-18-39-33;1-22-32(39-21-33-22)31(38)18-23-5-10-28(11-6-23)36-29-14-7-24(17-26(29)20-34-36)19-30(37)25-8-12-27(13-9-25)35-15-3-2-4-16-35;36-28-13-15-34(16-14-28)26-10-6-24(7-11-26)30(37)19-22-3-8-27(9-4-22)35-29-12-5-23(18-25(29)21-33-35)20-31(38)32-2-1-17-39-32;1-22-14-15-34(21-22)27-11-7-25(8-12-27)30(36)19-24-6-13-29-26(17-24)20-33-35(29)28-9-4-23(5-10-28)18-31(37)32-3-2-16-38-32;36-29(24-7-11-26(12-8-24)34-14-2-1-3-15-34)18-23-6-13-28-25(16-23)19-33-35(28)27-9-4-22(5-10-27)17-30(37)31-20-32-21-38-31;1-32(14-15-34)25-11-7-23(8-12-25)28(35)18-21-4-9-26(10-5-21)33-27-13-6-22(17-24(27)20-31-33)19-29(36)30-3-2-16-37-30/h2-13,18-19,22-23H,14-17,20-21H2,1H3;5-14,17,20-21H,2-4,15-16,18-19H2,1H3;1-12,17-18,21,28,36H,13-16,19-20H2;2-13,16-17,20,22H,14-15,18-19,21H2,1H3;4-13,16,19-21H,1-3,14-15,17-18H2;2-13,16-17,20,34H,14-15,18-19H2,1H3
InChIKeyLSIJGTLIPCJMGM-UHFFFAOYSA-N
XLogP38.18
TPSA397.44 Ų
H-Bond Donors2
H-Bond Acceptors40
Rotatable Bonds50
Heavy Atoms230
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003154.01
LogP ≤ 538.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1040

Analyze 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone?
The IUPAC name of 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone (CID 159442419) is 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone.
What is the SMILES notation for 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone?
The canonical SMILES for 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone is CC1CCN(c2ccc(C(=O)Cc3ccc4c(cnn4-c4ccc(CC(=O)c5cccs5)cc4)c3)cc2)C1.CC1CCN(c2ccc(C(=O)Cc3ccc4c(cnn4-c4ccc(CC(=O)c5cccs5)cc4)c3)cc2)CC1.CN(CCO)c1ccc(C(=O)Cc2ccc(-n3ncc4cc(CC(=O)c5cccs5)ccc43)cc2)cc1.Cc1ncsc1C(=O)Cc1ccc(-n2ncc3cc(CC(=O)c4ccc(N5CCCCC5)cc4)ccc32)cc1.O=C(Cc1ccc(-n2ncc3cc(CC(=O)c4cccs4)ccc32)cc1)c1ccc(N2CCC(O)CC2)cc1.O=C(Cc1ccc2c(cnn2-c2ccc(CC(=O)c3cncs3)cc2)c1)c1ccc(N2CCCCC2)cc1.
What is the InChIKey of 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone?
The InChIKey is LSIJGTLIPCJMGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H31N3O2S.C32H30N4O2S.C32H29N3O3S.C32H29N3O2S.C31H28N4O2S.C30H27N3O3S/c1-23-14-16-35(17-15-23)28-11-7-26(8-12-28)31(37)21-25-6-13-30-27(19-25)22-34-36(30)29-9-4-24(5-10-29)20-32(38)33-3-2-18-39-33;1-22-32(39-21-33-22)31(38)18-23-5-10-28(11-6-23)36-29-14-7-24(17-26(29)20-34-36)19-30(37)25-8-12-27(13-9-25)35-15-3-2-4-16-35;36-28-13-15-34(16-14-28)26-10-6-24(7-11-26)30(37)19-22-3-8-27(9-4-22)35-29-12-5-23(18-25(29)21-33-35)20-31(38)32-2-1-17-39-32;1-22-14-15-34(21-22)27-11-7-25(8-12-27)30(36)19-24-6-13-29-26(17-24)20-33-35(29)28-9-4-23(5-10-28)18-31(37)32-3-2-16-38-32;36-29(24-7-11-26(12-8-24)34-14-2-1-3-15-34)18-23-6-13-28-25(16-23)19-33-35(28)27-9-4-22(5-10-27)17-30(37)31-20-32-21-38-31;1-32(14-15-34)25-11-7-23(8-12-25)28(35)18-21-4-9-26(10-5-21)33-27-13-6-22(17-24(27)20-31-33)19-29(36)30-3-2-16-37-30/h2-13,18-19,22-23H,14-17,20-21H2,1H3;5-14,17,20-21H,2-4,15-16,18-19H2,1H3;1-12,17-18,21,28,36H,13-16,19-20H2;2-13,16-17,20,22H,14-15,18-19,21H2,1H3;4-13,16,19-21H,1-3,14-15,17-18H2;2-13,16-17,20,34H,14-15,18-19H2,1H3.
What are the key properties of 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone?
1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone has a molecular weight of 3154.01 g/mol, XLogP of 38.18, 50 rotatable bonds, 2 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[2-hydroxyethyl(methyl)amino]phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;1-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-[4-[5-(2-oxo-2-thiophen-2-ylethyl)indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-[4-(4-methylpiperidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;2-[4-[5-[2-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-oxoethyl]indazol-1-yl]phenyl]-1-thiophen-2-ylethanone;1-(4-methyl-1,3-thiazol-5-yl)-2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]ethanone;2-[4-[5-[2-oxo-2-(4-piperidin-1-ylphenyl)ethyl]indazol-1-yl]phenyl]-1-(1,3-thiazol-5-yl)ethanone is sourced from PubChem (CID 159442419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).