2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one

C140H154ClFN28O11S2 — CID 161383935

IUPAC2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one
SMILESC/N=C1\NC(=O)C[C@@](C)(c2cccc(-c3cc(OC)ccc3F)c2)N1.CCn1cc2ccc([C@]3(C)CC(=O)N(C)C(N)=N3)cc2n1.CN1C(=O)C[C@@](C)(C2CCCN(C(=O)c3cccc(C#N)c3)C2)N=C1N.CN1C(=O)C[C@@](C)(c2cc(-c3ccc(C#N)cc3)c3sccc3c2)N=C1N.CN1C(=O)[C@H](c2ccc(C3CC3)cc2)[C@@](C)(c2cc3cccc(C#N)c3s2)N=C1N.COC1CCCN(c2cccc([C@]3(C)CC(=O)N(C)C(N)=N3)c2)C1.NC1=NC(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)C(=O)N1C1CCC(O)CC1
InChIInChI=1S/C24H26ClN3O2.C24H22N4OS.C21H18N4OS.C19H20FN3O2.C19H23N5O2.C18H26N4O2.C15H19N5O/c25-19-6-2-4-16(14-19)15-3-1-5-18(13-15)24(17-7-8-17)22(30)28(23(26)27-24)20-9-11-21(29)12-10-20;1-24(19-12-17-4-3-5-18(13-25)21(17)30-19)20(22(29)28(2)23(26)27-24)16-10-8-15(9-11-16)14-6-7-14;1-21(11-18(26)25(2)20(23)24-21)16-9-15-7-8-27-19(15)17(10-16)14-5-3-13(12-22)4-6-14;1-19(11-17(24)22-18(21-2)23-19)13-6-4-5-12(9-13)15-10-14(25-3)7-8-16(15)20;1-19(10-16(25)23(2)18(21)22-19)15-7-4-8-24(12-15)17(26)14-6-3-5-13(9-14)11-20;1-18(11-16(23)21(2)17(19)20-18)13-6-4-7-14(10-13)22-9-5-8-15(12-22)24-3;1-4-20-9-10-5-6-11(7-12(10)18-20)15(2)8-13(21)19(3)14(16)17-15/h1-6,13-14,17,20-21,29H,7-12H2,(H2,26,27);3-5,8-12,14,20H,6-7H2,1-2H3,(H2,26,27);3-10H,11H2,1-2H3,(H2,23,24);4-10H,11H2,1-3H3,(H2,21,22,23,24);3,5-6,9,15H,4,7-8,10,12H2,1-2H3,(H2,21,22);4,6-7,10,15H,5,8-9,11-12H2,1-3H3,(H2,19,20);5-7,9H,4,8H2,1-3H3,(H2,16,17)/t;20-,24+;21-;19-;15?,19-;15?,18-;15-/m.000000/s1
InChIKeyVSBVKQCPYPERSE-GPCMOZEVSA-N
MW2523.54 g/mol
LogP19.64
Rot. Bonds19

About 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one

2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one (PubChem CID 161383935) has the molecular formula C140H154ClFN28O11S2 and a molecular weight of 2523.54 g/mol. Its IUPAC name is 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one.

Molecular Properties

Compound Name2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one
PubChem CID161383935
Molecular FormulaC140H154ClFN28O11S2
Molecular Weight2523.54 g/mol
Exact Mass2521.15
IUPAC Name2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one
SMILESC/N=C1\NC(=O)C[C@@](C)(c2cccc(-c3cc(OC)ccc3F)c2)N1.CCn1cc2ccc([C@]3(C)CC(=O)N(C)C(N)=N3)cc2n1.CN1C(=O)C[C@@](C)(C2CCCN(C(=O)c3cccc(C#N)c3)C2)N=C1N.CN1C(=O)C[C@@](C)(c2cc(-c3ccc(C#N)cc3)c3sccc3c2)N=C1N.CN1C(=O)[C@H](c2ccc(C3CC3)cc2)[C@@](C)(c2cc3cccc(C#N)c3s2)N=C1N.COC1CCCN(c2cccc([C@]3(C)CC(=O)N(C)C(N)=N3)c2)C1.NC1=NC(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)C(=O)N1C1CCC(O)CC1
InChIInChI=1S/C24H26ClN3O2.C24H22N4OS.C21H18N4OS.C19H20FN3O2.C19H23N5O2.C18H26N4O2.C15H19N5O/c25-19-6-2-4-16(14-19)15-3-1-5-18(13-15)24(17-7-8-17)22(30)28(23(26)27-24)20-9-11-21(29)12-10-20;1-24(19-12-17-4-3-5-18(13-25)21(17)30-19)20(22(29)28(2)23(26)27-24)16-10-8-15(9-11-16)14-6-7-14;1-21(11-18(26)25(2)20(23)24-21)16-9-15-7-8-27-19(15)17(10-16)14-5-3-13(12-22)4-6-14;1-19(11-17(24)22-18(21-2)23-19)13-6-4-5-12(9-13)15-10-14(25-3)7-8-16(15)20;1-19(10-16(25)23(2)18(21)22-19)15-7-4-8-24(12-15)17(26)14-6-3-5-13(9-14)11-20;1-18(11-16(23)21(2)17(19)20-18)13-6-4-7-14(10-13)22-9-5-8-15(12-22)24-3;1-4-20-9-10-5-6-11(7-12(10)18-20)15(2)8-13(21)19(3)14(16)17-15/h1-6,13-14,17,20-21,29H,7-12H2,(H2,26,27);3-5,8-12,14,20H,6-7H2,1-2H3,(H2,26,27);3-10H,11H2,1-2H3,(H2,23,24);4-10H,11H2,1-3H3,(H2,21,22,23,24);3,5-6,9,15H,4,7-8,10,12H2,1-2H3,(H2,21,22);4,6-7,10,15H,5,8-9,11-12H2,1-3H3,(H2,19,20);5-7,9H,4,8H2,1-3H3,(H2,16,17)/t;20-,24+;21-;19-;15?,19-;15?,18-;15-/m.000000/s1
InChIKeyVSBVKQCPYPERSE-GPCMOZEVSA-N
XLogP19.64
TPSA557.06 Ų
H-Bond Donors9
H-Bond Acceptors32
Rotatable Bonds19
Heavy Atoms183
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002523.54
LogP ≤ 519.64
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one?
The IUPAC name of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one (CID 161383935) is 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one.
What is the SMILES notation for 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one?
The canonical SMILES for 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one is C/N=C1\NC(=O)C[C@@](C)(c2cccc(-c3cc(OC)ccc3F)c2)N1.CCn1cc2ccc([C@]3(C)CC(=O)N(C)C(N)=N3)cc2n1.CN1C(=O)C[C@@](C)(C2CCCN(C(=O)c3cccc(C#N)c3)C2)N=C1N.CN1C(=O)C[C@@](C)(c2cc(-c3ccc(C#N)cc3)c3sccc3c2)N=C1N.CN1C(=O)[C@H](c2ccc(C3CC3)cc2)[C@@](C)(c2cc3cccc(C#N)c3s2)N=C1N.COC1CCCN(c2cccc([C@]3(C)CC(=O)N(C)C(N)=N3)c2)C1.NC1=NC(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)C(=O)N1C1CCC(O)CC1.
What is the InChIKey of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one?
The InChIKey is VSBVKQCPYPERSE-GPCMOZEVSA-N. The full InChI is InChI=1S/C24H26ClN3O2.C24H22N4OS.C21H18N4OS.C19H20FN3O2.C19H23N5O2.C18H26N4O2.C15H19N5O/c25-19-6-2-4-16(14-19)15-3-1-5-18(13-15)24(17-7-8-17)22(30)28(23(26)27-24)20-9-11-21(29)12-10-20;1-24(19-12-17-4-3-5-18(13-25)21(17)30-19)20(22(29)28(2)23(26)27-24)16-10-8-15(9-11-16)14-6-7-14;1-21(11-18(26)25(2)20(23)24-21)16-9-15-7-8-27-19(15)17(10-16)14-5-3-13(12-22)4-6-14;1-19(11-17(24)22-18(21-2)23-19)13-6-4-5-12(9-13)15-10-14(25-3)7-8-16(15)20;1-19(10-16(25)23(2)18(21)22-19)15-7-4-8-24(12-15)17(26)14-6-3-5-13(9-14)11-20;1-18(11-16(23)21(2)17(19)20-18)13-6-4-7-14(10-13)22-9-5-8-15(12-22)24-3;1-4-20-9-10-5-6-11(7-12(10)18-20)15(2)8-13(21)19(3)14(16)17-15/h1-6,13-14,17,20-21,29H,7-12H2,(H2,26,27);3-5,8-12,14,20H,6-7H2,1-2H3,(H2,26,27);3-10H,11H2,1-2H3,(H2,23,24);4-10H,11H2,1-3H3,(H2,21,22,23,24);3,5-6,9,15H,4,7-8,10,12H2,1-2H3,(H2,21,22);4,6-7,10,15H,5,8-9,11-12H2,1-3H3,(H2,19,20);5-7,9H,4,8H2,1-3H3,(H2,16,17)/t;20-,24+;21-;19-;15?,19-;15?,18-;15-/m.000000/s1.
What are the key properties of 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one?
2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one has a molecular weight of 2523.54 g/mol, XLogP of 19.64, 19 rotatable bonds, 9 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(4-hydroxycyclohexyl)imidazol-4-one;2-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophene-7-carbonitrile;4-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1-benzothiophen-7-yl]benzonitrile;3-[3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]piperidine-1-carbonyl]benzonitrile;(6S)-2-amino-6-(2-ethylindazol-6-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[3-(3-methoxypiperidin-1-yl)phenyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-6-[3-(2-fluoro-5-methoxyphenyl)phenyl]-6-methyl-2-methylimino-1,3-diazinan-4-one is sourced from PubChem (CID 161383935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).