2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide

C134H153Cl2FN24O8S3 — CID 159159334

IUPAC2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide
SMILESCN1C(=O)C(c2cccc(-c3cncc(F)c3)c2)(C2CC2)N=C1N.CN1C(=O)[C@@](CCC2CCCCC2)(CC2CCC[C@@H](NC(=O)NC3CCCCC3)C2)N=C1N.Cc1csc(-c2cccc(C3(C4CC4)N=C(N)N(C)C3=O)c2)c1.NC1=NC(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)C(=O)N1Cc1ccsc1.NC1=NC(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)C(=O)N1Cc1nccs1.NC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC1CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C27H33N5O2.C26H45N5O2.C23H20ClN3OS.C22H19ClN4OS.C18H17FN4O.C18H19N3OS/c28-25-30-27(21-9-3-1-4-10-21,22-11-5-2-6-12-22)24(33)32(25)19-20-15-17-31(18-16-20)26(34)29-23-13-7-8-14-23;1-31-23(32)26(30-24(31)27,16-15-19-9-4-2-5-10-19)18-20-11-8-14-22(17-20)29-25(33)28-21-12-6-3-7-13-21;24-20-6-2-4-17(12-20)16-3-1-5-19(11-16)23(18-7-8-18)21(28)27(22(25)26-23)13-15-9-10-29-14-15;23-18-6-2-4-15(12-18)14-3-1-5-17(11-14)22(16-7-8-16)20(28)27(21(24)26-22)13-19-25-9-10-29-19;1-23-16(24)18(13-5-6-13,22-17(23)20)14-4-2-3-11(7-14)12-8-15(19)10-21-9-12;1-11-8-15(23-10-11)12-4-3-5-14(9-12)18(13-6-7-13)16(22)21(2)17(19)20-18/h1-6,9-12,20,23H,7-8,13-19H2,(H2,28,30)(H,29,34);19-22H,2-18H2,1H3,(H2,27,30)(H2,28,29,33);1-6,9-12,14,18H,7-8,13H2,(H2,25,26);1-6,9-12,16H,7-8,13H2,(H2,24,26);2-4,7-10,13H,5-6H2,1H3,(H2,20,22);3-5,8-10,13H,6-7H2,1-2H3,(H2,19,20)/t;20?,22-,26-;;;;/m.1..../s1
InChIKeyKKHKDKSAFLNIGO-GSPNTWOUSA-N
MW2413.96 g/mol
LogP22.76
Rot. Bonds28

About 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide

2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide (PubChem CID 159159334) has the molecular formula C134H153Cl2FN24O8S3 and a molecular weight of 2413.96 g/mol. Its IUPAC name is 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide.

Molecular Properties

Compound Name2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide
PubChem CID159159334
Molecular FormulaC134H153Cl2FN24O8S3
Molecular Weight2413.96 g/mol
Exact Mass2411.08
IUPAC Name2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide
SMILESCN1C(=O)C(c2cccc(-c3cncc(F)c3)c2)(C2CC2)N=C1N.CN1C(=O)[C@@](CCC2CCCCC2)(CC2CCC[C@@H](NC(=O)NC3CCCCC3)C2)N=C1N.Cc1csc(-c2cccc(C3(C4CC4)N=C(N)N(C)C3=O)c2)c1.NC1=NC(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)C(=O)N1Cc1ccsc1.NC1=NC(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)C(=O)N1Cc1nccs1.NC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC1CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C27H33N5O2.C26H45N5O2.C23H20ClN3OS.C22H19ClN4OS.C18H17FN4O.C18H19N3OS/c28-25-30-27(21-9-3-1-4-10-21,22-11-5-2-6-12-22)24(33)32(25)19-20-15-17-31(18-16-20)26(34)29-23-13-7-8-14-23;1-31-23(32)26(30-24(31)27,16-15-19-9-4-2-5-10-19)18-20-11-8-14-22(17-20)29-25(33)28-21-12-6-3-7-13-21;24-20-6-2-4-17(12-20)16-3-1-5-19(11-16)23(18-7-8-18)21(28)27(22(25)26-23)13-15-9-10-29-14-15;23-18-6-2-4-15(12-18)14-3-1-5-17(11-14)22(16-7-8-16)20(28)27(21(24)26-22)13-19-25-9-10-29-19;1-23-16(24)18(13-5-6-13,22-17(23)20)14-4-2-3-11(7-14)12-8-15(19)10-21-9-12;1-11-8-15(23-10-11)12-4-3-5-14(9-12)18(13-6-7-13)16(22)21(2)17(19)20-18/h1-6,9-12,20,23H,7-8,13-19H2,(H2,28,30)(H,29,34);19-22H,2-18H2,1H3,(H2,27,30)(H2,28,29,33);1-6,9-12,14,18H,7-8,13H2,(H2,25,26);1-6,9-12,16H,7-8,13H2,(H2,24,26);2-4,7-10,13H,5-6H2,1H3,(H2,20,22);3-5,8-10,13H,6-7H2,1-2H3,(H2,19,20)/t;20?,22-,26-;;;;/m.1..../s1
InChIKeyKKHKDKSAFLNIGO-GSPNTWOUSA-N
XLogP22.76
TPSA451.39 Ų
H-Bond Donors9
H-Bond Acceptors25
Rotatable Bonds28
Heavy Atoms172
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002413.96
LogP ≤ 522.76
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1025

Analyze 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide with MolForge

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Related Compounds

2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one
CID 157316905
2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide
CID 157924324
(5S,6S)-2-amino-5-butyl-6-(3-iodophenyl)-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-5-butyl-6-(3-iodophenyl)-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-phenylethyl)imidazol-4-one;(5S,6S)-2-amino-5-(4-cyclopropylphenyl)-3,6-dimethyl-6-(4-pyridin-3-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5R,6S)-2-amino-5-(4-cyclopropylphenyl)-3,6-dimethyl-6-(4-pyridin-3-ylthiophen-2-yl)-5H-pyrimidin-4-one;N-[2-[2-[3-(2-amino-1,4-dimethyl-5-oxoimidazol-4-yl)phenyl]-4-chlorophenyl]ethyl]benzamide
CID 158479147
(6S)-2-amino-6-(1-benzothiophen-5-yl)-6-methyl-3-(pyridin-4-ylmethyl)-5H-pyrimidin-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-3-cyclopentyl-5-cyclopropylimidazol-4-one;(5R)-2-amino-5-cyclopropyl-5-[3-(2-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;3-[(4S,5S)-2-amino-1,4-dimethyl-5-[4-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-6-oxo-5H-pyrimidin-4-yl]benzonitrile;3-[(4S,5R)-2-amino-1,4-dimethyl-5-[4-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-6-oxo-5H-pyrimidin-4-yl]benzonitrile;5-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5-phenylsulfanyl-5H-pyrimidin-4-yl]thiophen-3-yl]pyridine-3-carbonitrile;1-[4-(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)butyl]-3-ethylurea
CID 158556948
(6S)-2-amino-6-(1-benzothiophen-5-yl)-3-[2-(dimethylamino)ethyl]-6-methyl-5H-pyrimidin-4-one;2-amino-6-[5-(3-chlorophenyl)thiophen-2-yl]-6-cyclopropyl-3-methyl-5H-pyrimidin-4-one;4-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]benzonitrile;(5R,6S)-2-amino-5-(4-cyclopropylphenyl)-6-[4-(2-fluoro-3-pyridinyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-3-carbonitrile;2-amino-3-[2-(1-methylpyrrolidin-2-yl)ethyl]-5,5-diphenylimidazol-4-one
CID 158780629
(5R)-2-amino-5-[[(1S,3R)-3-(1,3-benzothiazol-2-ylamino)cyclohexyl]methyl]-5-(2-cyclohexylethyl)-3-methylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(3-pyrrol-1-ylpropyl)imidazol-4-one;2-amino-5-[4-(3-chlorophenyl)thiophen-2-yl]-5-cyclopropyl-3-methylimidazol-4-one
CID 159209294
3-[[3-(4-acetylpiperazine-1-carbonyl)phenyl]methyl]-2-amino-5,5-diphenylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-3-[[(3S)-1-cyclohexylpyrrolidin-3-yl]methyl]-5-methylimidazol-4-one;2-amino-3-[2-(dimethylamino)ethyl]-5,5-diphenylimidazol-4-one;(6S)-2-amino-3,6-dimethyl-6-(4-thiophen-2-yl-2-pyridinyl)-5H-pyrimidin-4-one;2-amino-3-methyl-5-[5-(3-methylsulfanylphenyl)thiophen-2-yl]-5-phenylimidazol-4-one;1-[4-(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)butyl]-3-(4-fluorophenyl)urea
CID 159280437
2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-2-ylmethyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-fluoropyridine-3-carboxamide;2-amino-5-cyclopropyl-3-methyl-5-[3-(5-methyl-3-pyridinyl)phenyl]imidazol-4-one
CID 159478898
(5R,6S)-2-amino-5-cyclopropyl-3,6-dimethyl-6-(5-pyridin-3-ylthiophen-2-yl)-5H-pyrimidin-4-one;5-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-3-carbonitrile;2-amino-3,5-dimethyl-5-[3-(5-methyl-3-pyridinyl)phenyl]imidazol-4-one;N-[3-[(2-amino-5,5-diphenyl-4H-imidazol-3-yl)methyl]phenyl]-3-fluorobenzamide;N-[4-(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)butyl]-3-chlorobenzamide
CID 160746628
2-amino-5-(3-aminophenyl)-3-methyl-5-phenylimidazol-4-one;(5R,6S)-2-amino-6-[4-(3-chloro-4-fluorophenyl)thiophen-2-yl]-5-cyclopropyl-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-(3-chlorothiophen-2-yl)-5-[4-(difluoromethyl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-6-cyclopropyl-3-methyl-6-thiophen-2-yl-5H-pyrimidin-4-one;2-amino-5,5-diphenyl-3-(thiophen-2-ylmethyl)imidazol-4-one;1-[4-[(4S,5S)-2-amino-4-[4-(5-fluoro-3-pyridinyl)thiophen-2-yl]-1,4-dimethyl-6-oxo-5H-pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;1-[4-[(4S,5R)-2-amino-4-[4-(5-fluoro-3-pyridinyl)thiophen-2-yl]-1,4-dimethyl-6-oxo-5H-pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile
CID 160920713
(5R)-2-amino-5-[[(1S,3R)-3-(1,3-benzothiazol-2-ylamino)cyclohexyl]methyl]-5-(2-cyclohexylethyl)-3-methylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(3-imidazol-1-ylpropyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(3-pyrrol-1-ylpropyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-propan-2-ylimidazol-4-one;2-amino-5-[4-(3-chlorophenyl)thiophen-2-yl]-5-cyclopropyl-3-methylimidazol-4-one;1-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-benzylurea
CID 161913187

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide?
The IUPAC name of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide (CID 159159334) is 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide.
What is the SMILES notation for 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide?
The canonical SMILES for 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide is CN1C(=O)C(c2cccc(-c3cncc(F)c3)c2)(C2CC2)N=C1N.CN1C(=O)[C@@](CCC2CCCCC2)(CC2CCC[C@@H](NC(=O)NC3CCCCC3)C2)N=C1N.Cc1csc(-c2cccc(C3(C4CC4)N=C(N)N(C)C3=O)c2)c1.NC1=NC(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)C(=O)N1Cc1ccsc1.NC1=NC(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)C(=O)N1Cc1nccs1.NC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC1CCN(C(=O)NC2CCCC2)CC1.
What is the InChIKey of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide?
The InChIKey is KKHKDKSAFLNIGO-GSPNTWOUSA-N. The full InChI is InChI=1S/C27H33N5O2.C26H45N5O2.C23H20ClN3OS.C22H19ClN4OS.C18H17FN4O.C18H19N3OS/c28-25-30-27(21-9-3-1-4-10-21,22-11-5-2-6-12-22)24(33)32(25)19-20-15-17-31(18-16-20)26(34)29-23-13-7-8-14-23;1-31-23(32)26(30-24(31)27,16-15-19-9-4-2-5-10-19)18-20-11-8-14-22(17-20)29-25(33)28-21-12-6-3-7-13-21;24-20-6-2-4-17(12-20)16-3-1-5-19(11-16)23(18-7-8-18)21(28)27(22(25)26-23)13-15-9-10-29-14-15;23-18-6-2-4-15(12-18)14-3-1-5-17(11-14)22(16-7-8-16)20(28)27(21(24)26-22)13-19-25-9-10-29-19;1-23-16(24)18(13-5-6-13,22-17(23)20)14-4-2-3-11(7-14)12-8-15(19)10-21-9-12;1-11-8-15(23-10-11)12-4-3-5-14(9-12)18(13-6-7-13)16(22)21(2)17(19)20-18/h1-6,9-12,20,23H,7-8,13-19H2,(H2,28,30)(H,29,34);19-22H,2-18H2,1H3,(H2,27,30)(H2,28,29,33);1-6,9-12,14,18H,7-8,13H2,(H2,25,26);1-6,9-12,16H,7-8,13H2,(H2,24,26);2-4,7-10,13H,5-6H2,1H3,(H2,20,22);3-5,8-10,13H,6-7H2,1-2H3,(H2,19,20)/t;20?,22-,26-;;;;/m.1..../s1.
What are the key properties of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide?
2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide has a molecular weight of 2413.96 g/mol, XLogP of 22.76, 28 rotatable bonds, 9 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1,3-thiazol-2-ylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-3-ylmethyl)imidazol-4-one;1-[(1R)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-3-cyclohexylurea;2-amino-5-cyclopropyl-5-[3-(5-fluoro-3-pyridinyl)phenyl]-3-methylimidazol-4-one;2-amino-5-cyclopropyl-3-methyl-5-[3-(4-methylthiophen-2-yl)phenyl]imidazol-4-one;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-cyclopentylpiperidine-1-carboxamide is sourced from PubChem (CID 159159334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).