2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one

C178H195Cl5F6N12O25 — CID 158998243

IUPAC2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one
SMILESCOc1cc2c(cc1N1CCOCC1)CC(Cc1c(C)cccc1Cl)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C(F)(F)F)ccc1NC(=O)C(C)(C)C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C)cc(Cl)c1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C)cnc1Cl)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(Cl)ccc1C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(C(F)(F)F)nc1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(Cl)cc1C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ncccc1C)C2=O
InChIInChI=1S/C27H31F3N2O4.4C22H24ClNO3.C21H23ClN2O3.C21H21F3N2O3.C21H24N2O3/c1-26(2,3)25(34)31-21-6-5-19(27(28,29)30)13-17(21)12-18-11-16-14-22(32-7-9-36-10-8-32)23(35-4)15-20(16)24(18)33;1-14-7-15(10-18(23)8-14)9-17-11-16-12-20(24-3-5-27-6-4-24)21(26-2)13-19(16)22(17)25;1-14-9-18(23)4-3-15(14)10-17-11-16-12-20(24-5-7-27-8-6-24)21(26-2)13-19(16)22(17)25;1-14-3-4-18(23)11-15(14)9-17-10-16-12-20(24-5-7-27-8-6-24)21(26-2)13-19(16)22(17)25;1-14-4-3-5-19(23)17(14)11-16-10-15-12-20(24-6-8-27-9-7-24)21(26-2)13-18(15)22(16)25;1-13-7-16(21(22)23-12-13)9-15-8-14-10-18(24-3-5-27-6-4-24)19(26-2)11-17(14)20(15)25;1-28-18-11-16-14(10-17(18)26-4-6-29-7-5-26)9-15(20(16)27)8-13-2-3-19(25-12-13)21(22,23)24;1-14-4-3-5-22-18(14)11-16-10-15-12-19(23-6-8-26-9-7-23)20(25-2)13-17(15)21(16)24/h5-6,13-15,18H,7-12H2,1-4H3,(H,31,34);7-8,10,12-13,17H,3-6,9,11H2,1-2H3;3-4,9,12-13,17H,5-8,10-11H2,1-2H3;3-4,11-13,17H,5-10H2,1-2H3;3-5,12-13,16H,6-11H2,1-2H3;7,10-12,15H,3-6,8-9H2,1-2H3;2-3,10-12,15H,4-9H2,1H3;3-5,12-13,16H,6-11H2,1-2H3
InChIKeyJRABZZYSTNXXPD-UHFFFAOYSA-N
MW3193.83 g/mol
LogP31.36
Rot. Bonds33

About 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one

2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one (PubChem CID 158998243) has the molecular formula C178H195Cl5F6N12O25 and a molecular weight of 3193.83 g/mol. Its IUPAC name is 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one.

Molecular Properties

Compound Name2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one
PubChem CID158998243
Molecular FormulaC178H195Cl5F6N12O25
Molecular Weight3193.83 g/mol
Exact Mass3189.27
IUPAC Name2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one
SMILESCOc1cc2c(cc1N1CCOCC1)CC(Cc1c(C)cccc1Cl)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C(F)(F)F)ccc1NC(=O)C(C)(C)C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C)cc(Cl)c1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C)cnc1Cl)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(Cl)ccc1C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(C(F)(F)F)nc1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(Cl)cc1C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ncccc1C)C2=O
InChIInChI=1S/C27H31F3N2O4.4C22H24ClNO3.C21H23ClN2O3.C21H21F3N2O3.C21H24N2O3/c1-26(2,3)25(34)31-21-6-5-19(27(28,29)30)13-17(21)12-18-11-16-14-22(32-7-9-36-10-8-32)23(35-4)15-20(16)24(18)33;1-14-7-15(10-18(23)8-14)9-17-11-16-12-20(24-3-5-27-6-4-24)21(26-2)13-19(16)22(17)25;1-14-9-18(23)4-3-15(14)10-17-11-16-12-20(24-5-7-27-8-6-24)21(26-2)13-19(16)22(17)25;1-14-3-4-18(23)11-15(14)9-17-10-16-12-20(24-5-7-27-8-6-24)21(26-2)13-19(16)22(17)25;1-14-4-3-5-19(23)17(14)11-16-10-15-12-20(24-6-8-27-9-7-24)21(26-2)13-18(15)22(16)25;1-13-7-16(21(22)23-12-13)9-15-8-14-10-18(24-3-5-27-6-4-24)19(26-2)11-17(14)20(15)25;1-28-18-11-16-14(10-17(18)26-4-6-29-7-5-26)9-15(20(16)27)8-13-2-3-19(25-12-13)21(22,23)24;1-14-4-3-5-22-18(14)11-16-10-15-12-19(23-6-8-26-9-7-23)20(25-2)13-17(15)21(16)24/h5-6,13-15,18H,7-12H2,1-4H3,(H,31,34);7-8,10,12-13,17H,3-6,9,11H2,1-2H3;3-4,9,12-13,17H,5-8,10-11H2,1-2H3;3-4,11-13,17H,5-10H2,1-2H3;3-5,12-13,16H,6-11H2,1-2H3;7,10-12,15H,3-6,8-9H2,1-2H3;2-3,10-12,15H,4-9H2,1H3;3-5,12-13,16H,6-11H2,1-2H3
InChIKeyJRABZZYSTNXXPD-UHFFFAOYSA-N
XLogP31.36
TPSA377.93 Ų
H-Bond Donors1
H-Bond Acceptors36
Rotatable Bonds33
Heavy Atoms226
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003193.83
LogP ≤ 531.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one?
The IUPAC name of 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one (CID 158998243) is 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one.
What is the SMILES notation for 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one?
The canonical SMILES for 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one is COc1cc2c(cc1N1CCOCC1)CC(Cc1c(C)cccc1Cl)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C(F)(F)F)ccc1NC(=O)C(C)(C)C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C)cc(Cl)c1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C)cnc1Cl)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(Cl)ccc1C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(C(F)(F)F)nc1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(Cl)cc1C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ncccc1C)C2=O.
What is the InChIKey of 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one?
The InChIKey is JRABZZYSTNXXPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H31F3N2O4.4C22H24ClNO3.C21H23ClN2O3.C21H21F3N2O3.C21H24N2O3/c1-26(2,3)25(34)31-21-6-5-19(27(28,29)30)13-17(21)12-18-11-16-14-22(32-7-9-36-10-8-32)23(35-4)15-20(16)24(18)33;1-14-7-15(10-18(23)8-14)9-17-11-16-12-20(24-3-5-27-6-4-24)21(26-2)13-19(16)22(17)25;1-14-9-18(23)4-3-15(14)10-17-11-16-12-20(24-5-7-27-8-6-24)21(26-2)13-19(16)22(17)25;1-14-3-4-18(23)11-15(14)9-17-10-16-12-20(24-5-7-27-8-6-24)21(26-2)13-19(16)22(17)25;1-14-4-3-5-19(23)17(14)11-16-10-15-12-20(24-6-8-27-9-7-24)21(26-2)13-18(15)22(16)25;1-13-7-16(21(22)23-12-13)9-15-8-14-10-18(24-3-5-27-6-4-24)19(26-2)11-17(14)20(15)25;1-28-18-11-16-14(10-17(18)26-4-6-29-7-5-26)9-15(20(16)27)8-13-2-3-19(25-12-13)21(22,23)24;1-14-4-3-5-22-18(14)11-16-10-15-12-19(23-6-8-26-9-7-23)20(25-2)13-17(15)21(16)24/h5-6,13-15,18H,7-12H2,1-4H3,(H,31,34);7-8,10,12-13,17H,3-6,9,11H2,1-2H3;3-4,9,12-13,17H,5-8,10-11H2,1-2H3;3-4,11-13,17H,5-10H2,1-2H3;3-5,12-13,16H,6-11H2,1-2H3;7,10-12,15H,3-6,8-9H2,1-2H3;2-3,10-12,15H,4-9H2,1H3;3-5,12-13,16H,6-11H2,1-2H3.
What are the key properties of 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one?
2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one has a molecular weight of 3193.83 g/mol, XLogP of 31.36, 33 rotatable bonds, 1 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chloro-6-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(3-chloro-5-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(4-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(5-chloro-2-methylphenyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one is sourced from PubChem (CID 158998243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).