2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile

C114H118ClN23O7S6 — CID 158322567

IUPAC2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile
SMILESCC(C)C(CO)N1C(=O)C(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)N=C1N.CCC[C@@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(-c2cccc(C#N)c2)cs1.CCC[C@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(-c2cccc(C#N)c2)cs1.CN1C(=O)C(c2cc(-c3ccc4[nH]ccc4c3)cs2)(C2CC2)N=C1N.CN1C(=O)C[C@@](C)(c2ccc(C#N)s2)N=C1N.CN1C(=O)[C@H](c2cccs2)[C@@](C)(c2cc(-c3cccc(C#N)c3)cs2)N=C1N
InChIInChI=1S/C23H26ClN3O2.C21H18N4OS2.2C20H22N4OS.C19H18N4OS.C11H12N4OS/c1-14(2)20(13-28)27-21(29)23(17-9-10-17,26-22(27)25)18-7-3-5-15(11-18)16-6-4-8-19(24)12-16;1-21(17-10-15(12-28-17)14-6-3-5-13(9-14)11-22)18(16-7-4-8-27-16)19(26)25(2)20(23)24-21;2*1-4-6-16-18(25)24(3)19(22)23-20(16,2)17-10-15(12-26-17)14-8-5-7-13(9-14)11-21;1-23-17(24)19(14-3-4-14,22-18(23)20)16-9-13(10-25-16)11-2-5-15-12(8-11)6-7-21-15;1-11(8-4-3-7(6-12)17-8)5-9(16)15(2)10(13)14-11/h3-8,11-12,14,17,20,28H,9-10,13H2,1-2H3,(H2,25,26);3-10,12,18H,1-2H3,(H2,23,24);2*5,7-10,12,16H,4,6H2,1-3H3,(H2,22,23);2,5-10,14,21H,3-4H2,1H3,(H2,20,22);3-4H,5H2,1-2H3,(H2,13,14)/t;18-,21+;16-,20+;16-,20-;;11-/m.010.0/s1
InChIKeyGPAJENPVOAXKBQ-XQJDYFDLSA-N
MW2150.21 g/mol
LogP19.63
Rot. Bonds21

About 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile

2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile (PubChem CID 158322567) has the molecular formula C114H118ClN23O7S6 and a molecular weight of 2150.21 g/mol. Its IUPAC name is 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile.

Molecular Properties

Compound Name2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile
PubChem CID158322567
Molecular FormulaC114H118ClN23O7S6
Molecular Weight2150.21 g/mol
Exact Mass2147.76
IUPAC Name2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile
SMILESCC(C)C(CO)N1C(=O)C(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)N=C1N.CCC[C@@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(-c2cccc(C#N)c2)cs1.CCC[C@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(-c2cccc(C#N)c2)cs1.CN1C(=O)C(c2cc(-c3ccc4[nH]ccc4c3)cs2)(C2CC2)N=C1N.CN1C(=O)C[C@@](C)(c2ccc(C#N)s2)N=C1N.CN1C(=O)[C@H](c2cccs2)[C@@](C)(c2cc(-c3cccc(C#N)c3)cs2)N=C1N
InChIInChI=1S/C23H26ClN3O2.C21H18N4OS2.2C20H22N4OS.C19H18N4OS.C11H12N4OS/c1-14(2)20(13-28)27-21(29)23(17-9-10-17,26-22(27)25)18-7-3-5-15(11-18)16-6-4-8-19(24)12-16;1-21(17-10-15(12-28-17)14-6-3-5-13(9-14)11-22)18(16-7-4-8-27-16)19(26)25(2)20(23)24-21;2*1-4-6-16-18(25)24(3)19(22)23-20(16,2)17-10-15(12-26-17)14-8-5-7-13(9-14)11-21;1-23-17(24)19(14-3-4-14,22-18(23)20)16-9-13(10-25-16)11-2-5-15-12(8-11)6-7-21-15;1-11(8-4-3-7(6-12)17-8)5-9(16)15(2)10(13)14-11/h3-8,11-12,14,17,20,28H,9-10,13H2,1-2H3,(H2,25,26);3-10,12,18H,1-2H3,(H2,23,24);2*5,7-10,12,16H,4,6H2,1-3H3,(H2,22,23);2,5-10,14,21H,3-4H2,1H3,(H2,20,22);3-4H,5H2,1-2H3,(H2,13,14)/t;18-,21+;16-,20+;16-,20-;;11-/m.010.0/s1
InChIKeyGPAJENPVOAXKBQ-XQJDYFDLSA-N
XLogP19.63
TPSA483.32 Ų
H-Bond Donors8
H-Bond Acceptors29
Rotatable Bonds21
Heavy Atoms151
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002150.21
LogP ≤ 519.63
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1029

Analyze 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile with MolForge

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Launch Full Analysis

Related Compounds

2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-[(2R)-1-hydroxy-4-methylpentan-2-yl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-3-methyl-5-[[(1S,3R)-3-[(1-methylbenzimidazol-2-yl)amino]cyclohexyl]methyl]imidazol-4-one;3-[5-[(4S)-2-amino-4-ethyl-1-methyl-6-oxo-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile
CID 158314120
(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
2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;2-amino-3-[[3-[2-(2-fluorophenyl)-2-oxoethyl]phenyl]methyl]-5,5-diphenylimidazol-4-one;(5R)-2-amino-3-methyl-5-[[(1S,3R)-3-(2-oxopropyl)cyclohexyl]methyl]-5-(2-phenylethyl)imidazol-4-one;3-(4-bromothiophen-2-yl)-2,3-dimethyl-1H-1,2,4-triazol-5-amine;3-[3-(3-chlorophenyl)phenyl]-3-cyclopropyl-1-[(2R)-1-hydroxy-3-methylbutan-2-yl]-5-iminopyrrolidin-2-one
CID 161224564
2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-[(2R)-1-hydroxy-4-methylpentan-2-yl]imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-pyridin-3-ylethyl)imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-3-methyl-5-[[(1S,3R)-3-[(1-methylbenzimidazol-2-yl)amino]cyclohexyl]methyl]imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-4-cyanobenzamide;3-[5-(2-amino-4-cyclopropyl-1-methyl-5-oxoimidazol-4-yl)thiophen-3-yl]benzonitrile
CID 162103531

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile?
The IUPAC name of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile (CID 158322567) is 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile.
What is the SMILES notation for 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile?
The canonical SMILES for 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile is CC(C)C(CO)N1C(=O)C(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)N=C1N.CCC[C@@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(-c2cccc(C#N)c2)cs1.CCC[C@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(-c2cccc(C#N)c2)cs1.CN1C(=O)C(c2cc(-c3ccc4[nH]ccc4c3)cs2)(C2CC2)N=C1N.CN1C(=O)C[C@@](C)(c2ccc(C#N)s2)N=C1N.CN1C(=O)[C@H](c2cccs2)[C@@](C)(c2cc(-c3cccc(C#N)c3)cs2)N=C1N.
What is the InChIKey of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile?
The InChIKey is GPAJENPVOAXKBQ-XQJDYFDLSA-N. The full InChI is InChI=1S/C23H26ClN3O2.C21H18N4OS2.2C20H22N4OS.C19H18N4OS.C11H12N4OS/c1-14(2)20(13-28)27-21(29)23(17-9-10-17,26-22(27)25)18-7-3-5-15(11-18)16-6-4-8-19(24)12-16;1-21(17-10-15(12-28-17)14-6-3-5-13(9-14)11-22)18(16-7-4-8-27-16)19(26)25(2)20(23)24-21;2*1-4-6-16-18(25)24(3)19(22)23-20(16,2)17-10-15(12-26-17)14-8-5-7-13(9-14)11-21;1-23-17(24)19(14-3-4-14,22-18(23)20)16-9-13(10-25-16)11-2-5-15-12(8-11)6-7-21-15;1-11(8-4-3-7(6-12)17-8)5-9(16)15(2)10(13)14-11/h3-8,11-12,14,17,20,28H,9-10,13H2,1-2H3,(H2,25,26);3-10,12,18H,1-2H3,(H2,23,24);2*5,7-10,12,16H,4,6H2,1-3H3,(H2,22,23);2,5-10,14,21H,3-4H2,1H3,(H2,20,22);3-4H,5H2,1-2H3,(H2,13,14)/t;18-,21+;16-,20+;16-,20-;;11-/m.010.0/s1.
What are the key properties of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile?
2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile has a molecular weight of 2150.21 g/mol, XLogP of 19.63, 21 rotatable bonds, 8 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(1-hydroxy-3-methylbutan-2-yl)imidazol-4-one;2-amino-5-cyclopropyl-5-[4-(1H-indol-5-yl)thiophen-2-yl]-3-methylimidazol-4-one;3-[5-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-propyl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]thiophene-2-carbonitrile;3-[5-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-thiophen-2-yl-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile is sourced from PubChem (CID 158322567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).