(6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile

C108H119F2N25O8S4 — CID 158973186

IUPAC(6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile
SMILESCN1C(=O)C[C@@](C)(C2CCCN(C(=O)NCCc3ccccc3)C2)N=C1N.CN1C(=O)C[C@@](C)(c2cc(-c3ccc(F)c(F)c3)c3sccc3c2)N=C1N.CN1C(=O)C[C@@](C)(c2ccc3scnc3c2)N=C1N.COc1cccc(-c2cncc([C@]3(C)CC(=O)N(C)C(N)=N3)n2)c1.Cc1sc([C@@]2(C)N=C(N)N(C)C(=O)[C@@H]2C)cc1-c1cccc(C#N)c1.Cc1sc([C@@]2(C)N=C(N)N(C)C(=O)[C@H]2C)cc1-c1cccc(C#N)c1
InChIInChI=1S/C20H17F2N3OS.C20H29N5O2.2C19H20N4OS.C17H19N5O2.C13H14N4OS/c1-20(10-17(26)25(2)19(23)24-20)13-7-12-5-6-27-18(12)14(9-13)11-3-4-15(21)16(22)8-11;1-20(13-17(26)24(2)18(21)23-20)16-9-6-12-25(14-16)19(27)22-11-10-15-7-4-3-5-8-15;2*1-11-17(24)23(4)18(21)22-19(11,3)16-9-15(12(2)25-16)14-7-5-6-13(8-14)10-20;1-17(8-15(23)22(2)16(18)21-17)14-10-19-9-13(20-14)11-5-4-6-12(7-11)24-3;1-13(6-11(18)17(2)12(14)16-13)8-3-4-10-9(5-8)15-7-19-10/h3-9H,10H2,1-2H3,(H2,23,24);3-5,7-8,16H,6,9-14H2,1-2H3,(H2,21,23)(H,22,27);2*5-9,11H,1-4H3,(H2,21,22);4-7,9-10H,8H2,1-3H3,(H2,18,21);3-5,7H,6H2,1-2H3,(H2,14,16)/t20-;16?,20-;11-,19+;11-,19-;17-;13-/m001000/s1
InChIKeyJOBMBWQLARRNDJ-DHSPGENASA-N
MW2061.57 g/mol
LogP15.52
Rot. Bonds14

About (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile

(6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile (PubChem CID 158973186) has the molecular formula C108H119F2N25O8S4 and a molecular weight of 2061.57 g/mol. Its IUPAC name is (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile.

Molecular Properties

Compound Name(6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile
PubChem CID158973186
Molecular FormulaC108H119F2N25O8S4
Molecular Weight2061.57 g/mol
Exact Mass2059.85
IUPAC Name(6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile
SMILESCN1C(=O)C[C@@](C)(C2CCCN(C(=O)NCCc3ccccc3)C2)N=C1N.CN1C(=O)C[C@@](C)(c2cc(-c3ccc(F)c(F)c3)c3sccc3c2)N=C1N.CN1C(=O)C[C@@](C)(c2ccc3scnc3c2)N=C1N.COc1cccc(-c2cncc([C@]3(C)CC(=O)N(C)C(N)=N3)n2)c1.Cc1sc([C@@]2(C)N=C(N)N(C)C(=O)[C@@H]2C)cc1-c1cccc(C#N)c1.Cc1sc([C@@]2(C)N=C(N)N(C)C(=O)[C@H]2C)cc1-c1cccc(C#N)c1
InChIInChI=1S/C20H17F2N3OS.C20H29N5O2.2C19H20N4OS.C17H19N5O2.C13H14N4OS/c1-20(10-17(26)25(2)19(23)24-20)13-7-12-5-6-27-18(12)14(9-13)11-3-4-15(21)16(22)8-11;1-20(13-17(26)24(2)18(21)23-20)16-9-6-12-25(14-16)19(27)22-11-10-15-7-4-3-5-8-15;2*1-11-17(24)23(4)18(21)22-19(11,3)16-9-15(12(2)25-16)14-7-5-6-13(8-14)10-20;1-17(8-15(23)22(2)16(18)21-17)14-10-19-9-13(20-14)11-5-4-6-12(7-11)24-3;1-13(6-11(18)17(2)12(14)16-13)8-3-4-10-9(5-8)15-7-19-10/h3-9H,10H2,1-2H3,(H2,23,24);3-5,7-8,16H,6,9-14H2,1-2H3,(H2,21,23)(H,22,27);2*5-9,11H,1-4H3,(H2,21,22);4-7,9-10H,8H2,1-3H3,(H2,18,21);3-5,7H,6H2,1-2H3,(H2,14,16)/t20-;16?,20-;11-,19+;11-,19-;17-;13-/m001000/s1
InChIKeyJOBMBWQLARRNDJ-DHSPGENASA-N
XLogP15.52
TPSA479.96 Ų
H-Bond Donors7
H-Bond Acceptors29
Rotatable Bonds14
Heavy Atoms147
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002061.57
LogP ≤ 515.52
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1029

Analyze (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile with MolForge

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Launch Full Analysis

Related Compounds

3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-[3-[5-methoxy-2-[[(4-methyl-1,3-thiazol-2-yl)amino]methyl]phenyl]phenyl]-5-methylimidazol-4-one;5-[5-[(4S,5R)-2-amino-5-(4-cyclopropylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-fluorothiophen-3-yl]pyridine-3-carbonitrile;2-[3-[5-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-fluorophenyl]phenyl]acetonitrile;2-amino-5,5-diphenyl-3-(pyridin-4-ylmethyl)imidazol-4-one;2-amino-4-[[3-(3-methoxyphenyl)phenyl]methyl]-1-methyl-4H-imidazol-5-one
CID 159949040
(6S)-2-amino-6-(1-benzothiophen-2-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(5S,6S)-2-amino-6-(2-bromo-4-pyridinyl)-5-cyclopropyl-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S)-2-amino-1,4-dimethyl-5-[(E)-3-(4-methylphenyl)prop-2-enyl]-6-oxo-5H-pyrimidin-4-yl]thiophen-3-yl]benzonitrile;(6S)-2-amino-3,6-dimethyl-6-[3-(3-methylpiperazin-1-yl)phenyl]-5H-pyrimidin-4-one;3-[(4S,5S)-2-amino-1,4-dimethyl-6-oxo-5-(4-propan-2-ylsulfonylphenyl)-5H-pyrimidin-4-yl]benzonitrile;3-[(4S,5R)-2-amino-1,4-dimethyl-6-oxo-5-(4-propan-2-ylsulfonylphenyl)-5H-pyrimidin-4-yl]benzonitrile;(6S)-2-amino-6-[5-(3-fluoro-5-methoxyphenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one
CID 162038227

Frequently Asked Questions

What is the IUPAC name of (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile?
The IUPAC name of (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile (CID 158973186) is (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile.
What is the SMILES notation for (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile?
The canonical SMILES for (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile is CN1C(=O)C[C@@](C)(C2CCCN(C(=O)NCCc3ccccc3)C2)N=C1N.CN1C(=O)C[C@@](C)(c2cc(-c3ccc(F)c(F)c3)c3sccc3c2)N=C1N.CN1C(=O)C[C@@](C)(c2ccc3scnc3c2)N=C1N.COc1cccc(-c2cncc([C@]3(C)CC(=O)N(C)C(N)=N3)n2)c1.Cc1sc([C@@]2(C)N=C(N)N(C)C(=O)[C@@H]2C)cc1-c1cccc(C#N)c1.Cc1sc([C@@]2(C)N=C(N)N(C)C(=O)[C@H]2C)cc1-c1cccc(C#N)c1.
What is the InChIKey of (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile?
The InChIKey is JOBMBWQLARRNDJ-DHSPGENASA-N. The full InChI is InChI=1S/C20H17F2N3OS.C20H29N5O2.2C19H20N4OS.C17H19N5O2.C13H14N4OS/c1-20(10-17(26)25(2)19(23)24-20)13-7-12-5-6-27-18(12)14(9-13)11-3-4-15(21)16(22)8-11;1-20(13-17(26)24(2)18(21)23-20)16-9-6-12-25(14-16)19(27)22-11-10-15-7-4-3-5-8-15;2*1-11-17(24)23(4)18(21)22-19(11,3)16-9-15(12(2)25-16)14-7-5-6-13(8-14)10-20;1-17(8-15(23)22(2)16(18)21-17)14-10-19-9-13(20-14)11-5-4-6-12(7-11)24-3;1-13(6-11(18)17(2)12(14)16-13)8-3-4-10-9(5-8)15-7-19-10/h3-9H,10H2,1-2H3,(H2,23,24);3-5,7-8,16H,6,9-14H2,1-2H3,(H2,21,23)(H,22,27);2*5-9,11H,1-4H3,(H2,21,22);4-7,9-10H,8H2,1-3H3,(H2,18,21);3-5,7H,6H2,1-2H3,(H2,14,16)/t20-;16?,20-;11-,19+;11-,19-;17-;13-/m001000/s1.
What are the key properties of (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile?
(6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile has a molecular weight of 2061.57 g/mol, XLogP of 15.52, 14 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-2-amino-6-(1,3-benzothiazol-5-yl)-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[7-(3,4-difluorophenyl)-1-benzothiophen-5-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-N-(2-phenylethyl)piperidine-1-carboxamide;(6S)-2-amino-6-[6-(3-methoxyphenyl)pyrazin-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;3-[5-[(4S,5S)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile;3-[5-[(4S,5R)-2-amino-1,4,5-trimethyl-6-oxo-5H-pyrimidin-4-yl]-2-methylthiophen-3-yl]benzonitrile is sourced from PubChem (CID 158973186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).