(3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one

C156H136N16O18 — CID 158110520

IUPAC(3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one
SMILESCc1cccc(C(=O)C[C@]2(O)C(=O)N(CCc3c[nH]c4ccccc34)c3ccccc32)c1.Cc1ccccc1C(=O)C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21.Nc1cccc(C(=O)C[C@]2(O)C(=O)N(CCc3c[nH]c4ccccc34)c3ccccc32)c1.Nc1ccccc1C(=O)C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21.O=C(C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21)c1cccnc1.O=C(C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21)c1ccncc1
InChIInChI=1S/2C27H24N2O3.2C26H23N3O3.2C25H21N3O3/c1-18-7-6-8-19(15-18)25(30)16-27(32)22-10-3-5-12-24(22)29(26(27)31)14-13-20-17-28-23-11-4-2-9-21(20)23;1-18-8-2-3-9-20(18)25(30)16-27(32)22-11-5-7-13-24(22)29(26(27)31)15-14-19-17-28-23-12-6-4-10-21(19)23;27-21-10-4-1-8-19(21)24(30)15-26(32)20-9-3-6-12-23(20)29(25(26)31)14-13-17-16-28-22-11-5-2-7-18(17)22;27-19-7-5-6-17(14-19)24(30)15-26(32)21-9-2-4-11-23(21)29(25(26)31)13-12-18-16-28-22-10-3-1-8-20(18)22;29-23(18-6-5-12-26-15-18)14-25(31)20-8-2-4-10-22(20)28(24(25)30)13-11-17-16-27-21-9-3-1-7-19(17)21;29-23(17-9-12-26-13-10-17)15-25(31)20-6-2-4-8-22(20)28(24(25)30)14-11-18-16-27-21-7-3-1-5-19(18)21/h2-12,15,17,28,32H,13-14,16H2,1H3;2-13,17,28,32H,14-16H2,1H3;1-12,16,28,32H,13-15,27H2;1-11,14,16,28,32H,12-13,15,27H2;1-10,12,15-16,27,31H,11,13-14H2;1-10,12-13,16,27,31H,11,14-15H2/t2*27-;2*26-;2*25-/m111111/s1
InChIKeyFQJIONJGJJODOV-CMUYHJHVSA-N
MW2522.90 g/mol
LogP23.88
Rot. Bonds36

About (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one

(3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one (PubChem CID 158110520) has the molecular formula C156H136N16O18 and a molecular weight of 2522.90 g/mol. Its IUPAC name is (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one.

Molecular Properties

Compound Name(3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one
PubChem CID158110520
Molecular FormulaC156H136N16O18
Molecular Weight2522.90 g/mol
Exact Mass2521.02
IUPAC Name(3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one
SMILESCc1cccc(C(=O)C[C@]2(O)C(=O)N(CCc3c[nH]c4ccccc34)c3ccccc32)c1.Cc1ccccc1C(=O)C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21.Nc1cccc(C(=O)C[C@]2(O)C(=O)N(CCc3c[nH]c4ccccc34)c3ccccc32)c1.Nc1ccccc1C(=O)C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21.O=C(C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21)c1cccnc1.O=C(C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21)c1ccncc1
InChIInChI=1S/2C27H24N2O3.2C26H23N3O3.2C25H21N3O3/c1-18-7-6-8-19(15-18)25(30)16-27(32)22-10-3-5-12-24(22)29(26(27)31)14-13-20-17-28-23-11-4-2-9-21(20)23;1-18-8-2-3-9-20(18)25(30)16-27(32)22-11-5-7-13-24(22)29(26(27)31)15-14-19-17-28-23-12-6-4-10-21(19)23;27-21-10-4-1-8-19(21)24(30)15-26(32)20-9-3-6-12-23(20)29(25(26)31)14-13-17-16-28-22-11-5-2-7-18(17)22;27-19-7-5-6-17(14-19)24(30)15-26(32)21-9-2-4-11-23(21)29(25(26)31)13-12-18-16-28-22-10-3-1-8-20(18)22;29-23(18-6-5-12-26-15-18)14-25(31)20-8-2-4-10-22(20)28(24(25)30)13-11-17-16-27-21-9-3-1-7-19(17)21;29-23(17-9-12-26-13-10-17)15-25(31)20-6-2-4-8-22(20)28(24(25)30)14-11-18-16-27-21-7-3-1-5-19(18)21/h2-12,15,17,28,32H,13-14,16H2,1H3;2-13,17,28,32H,14-16H2,1H3;1-12,16,28,32H,13-15,27H2;1-11,14,16,28,32H,12-13,15,27H2;1-10,12,15-16,27,31H,11,13-14H2;1-10,12-13,16,27,31H,11,14-15H2/t2*27-;2*26-;2*25-/m111111/s1
InChIKeyFQJIONJGJJODOV-CMUYHJHVSA-N
XLogP23.88
TPSA518.22 Ų
H-Bond Donors14
H-Bond Acceptors22
Rotatable Bonds36
Heavy Atoms190
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002522.90
LogP ≤ 523.88
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one with MolForge

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Launch Full Analysis

Related Compounds

bis((3R)-1-benzyl-3-hydroxy-3-(1H-indol-3-yl)-7-(trifluoromethyl)indol-2-one);bis((3S)-1-benzyl-3-hydroxy-3-(1H-indol-3-yl)-7-(trifluoromethyl)indol-2-one)
CID 139051028
5-(4-benzylpiperidine-1-carbonyl)-1H-indole-3-carboxylic acid;1-[5-(4-benzylpiperidine-1-carbonyl)-1H-indol-3-yl]-2,2,2-trifluoroethanone;5-(4-benzylpiperidine-1-carbonyl)-N-methylidene-1H-indole-3-carboxamide;(4-benzylpiperidin-1-yl)-(1H-indol-5-yl)methanone
CID 91147509
5-(4-benzylpiperidine-1-carbonyl)-1H-indole-3-carboxylic acid;1-[5-(4-benzylpiperidine-1-carbonyl)-1H-indol-3-yl]ethanone;1-[5-(4-benzylpiperidine-1-carbonyl)-1H-indol-3-yl]-2,2,2-trifluoroethanone;(4-benzylpiperidin-1-yl)-(1H-indol-5-yl)methanone
CID 157792691
3-(2-(1H-indol-3-yl)-2-oxoethyl)-3-hydroxy-5-methyl-1-propylindolin-2-one
CID 86300684
1-[1-benzyl-5-(dihydroxymethyl)indol-3-yl]ethanone;1-(1-benzyl-5-methylindol-3-yl)ethanone;1-benzyl-5-(methylperoxymethyl)indole;1-[1-benzyl-5-(methylperoxymethyl)indol-3-yl]ethanone;1H-indol-5-ylmethanediol;5-(methylperoxymethyl)-1H-indole
CID 90722680
5-(4-benzylpiperidine-1-carbonyl)-1H-indole-3-carboxylic acid;1-[5-(4-benzylpiperidine-1-carbonyl)-1H-indol-3-yl]ethanone
CID 91159895
1-[1-benzyl-5-(dihydroxymethyl)indol-3-yl]ethanone;1-(1-benzyl-5-methylindol-3-yl)ethanone;1-benzyl-5-(methylperoxymethyl)indole;1-[1-benzyl-5-(methylperoxymethyl)indol-3-yl]ethanone;5-(methylperoxymethyl)-1H-indole
CID 91178410
3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one
CID 142489461
(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one
CID 155378090
(3S)-3-hydroxy-1-(4-isocyano-3-methylphenyl)-3-methyl-4-(4-methylindol-1-yl)butan-2-one;(3R)-3-hydroxy-1-(4-isocyano-3-methylphenyl)-3-methyl-4-(5-methylindol-1-yl)butan-2-one;tris((3S)-3-hydroxy-1-(4-isocyano-3-methylphenyl)-3-methyl-4-(5-methylindol-1-yl)butan-2-one);1-[(2S)-2-hydroxy-4-(4-isocyano-3-methylphenyl)-2-methyl-3-oxobutyl]indole-3-carboxylic acid
CID 157464158
2-(3H-inden-1-yl)-1,2-bis(1H-indol-3-yl)ethanone;3-[1-(3H-inden-1-yl)ethyl]-1H-indole;1-(3H-inden-1-yl)-1-(1H-indol-3-yl)butan-2-ol;3-[3H-inden-1-yl(1H-indol-3-yl)methyl]-1H-indole;3-(3H-inden-1-ylmethyl)-1H-indole;3-[3H-inden-1-yl(naphthalen-1-yl)methyl]-1H-indole
CID 157471665
1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraene-3-carbonyl chloride;1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraene-3-carboxylic acid;5-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)-4-(1H-indol-3-yl)-1,2-dihydropyrrol-3-one;tert-butyl 3-[1-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)-3-methoxy-1,3-dioxopropan-2-yl]indole-1-carboxylate;tert-butyl 3-(2-oxopropyl)indole-1-carboxylate;methanamine
CID 157563527

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one?
The IUPAC name of (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one (CID 158110520) is (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one.
What is the SMILES notation for (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one?
The canonical SMILES for (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one is Cc1cccc(C(=O)C[C@]2(O)C(=O)N(CCc3c[nH]c4ccccc34)c3ccccc32)c1.Cc1ccccc1C(=O)C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21.Nc1cccc(C(=O)C[C@]2(O)C(=O)N(CCc3c[nH]c4ccccc34)c3ccccc32)c1.Nc1ccccc1C(=O)C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21.O=C(C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21)c1cccnc1.O=C(C[C@]1(O)C(=O)N(CCc2c[nH]c3ccccc23)c2ccccc21)c1ccncc1.
What is the InChIKey of (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one?
The InChIKey is FQJIONJGJJODOV-CMUYHJHVSA-N. The full InChI is InChI=1S/2C27H24N2O3.2C26H23N3O3.2C25H21N3O3/c1-18-7-6-8-19(15-18)25(30)16-27(32)22-10-3-5-12-24(22)29(26(27)31)14-13-20-17-28-23-11-4-2-9-21(20)23;1-18-8-2-3-9-20(18)25(30)16-27(32)22-11-5-7-13-24(22)29(26(27)31)15-14-19-17-28-23-12-6-4-10-21(19)23;27-21-10-4-1-8-19(21)24(30)15-26(32)20-9-3-6-12-23(20)29(25(26)31)14-13-17-16-28-22-11-5-2-7-18(17)22;27-19-7-5-6-17(14-19)24(30)15-26(32)21-9-2-4-11-23(21)29(25(26)31)13-12-18-16-28-22-10-3-1-8-20(18)22;29-23(18-6-5-12-26-15-18)14-25(31)20-8-2-4-10-22(20)28(24(25)30)13-11-17-16-27-21-9-3-1-7-19(17)21;29-23(17-9-12-26-13-10-17)15-25(31)20-6-2-4-8-22(20)28(24(25)30)14-11-18-16-27-21-7-3-1-5-19(18)21/h2-12,15,17,28,32H,13-14,16H2,1H3;2-13,17,28,32H,14-16H2,1H3;1-12,16,28,32H,13-15,27H2;1-11,14,16,28,32H,12-13,15,27H2;1-10,12,15-16,27,31H,11,13-14H2;1-10,12-13,16,27,31H,11,14-15H2/t2*27-;2*26-;2*25-/m111111/s1.
What are the key properties of (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one?
(3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one has a molecular weight of 2522.90 g/mol, XLogP of 23.88, 36 rotatable bonds, 14 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[2-(2-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-[2-(3-aminophenyl)-2-oxoethyl]-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(2-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-[2-(3-methylphenyl)-2-oxoethyl]indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-3-ylethyl)indol-2-one;(3R)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one is sourced from PubChem (CID 158110520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).