(6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one

C102H117ClFN25O13S7 — CID 159654898

IUPAC(6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one
SMILESCCOc1cc(F)cc(-c2cnc([C@]3(C)CC(=O)N(C)C(N)=N3)s2)c1.CCS(=O)(=O)N1CCC(CN2C(=O)C(c3ccccc3)(c3ccccc3)N=C2N)CC1.CN1C(=O)C(c2ccc3occc3c2)[C@@](C)(c2cc(-c3ccc(Cl)nn3)cs2)N=C1N.CN1C(=O)[C@@H](C2CCN(S(C)(=O)=O)CC2)[C@@](C)(c2cc(-c3cncnc3)cs2)N=C1N.CN1C(=O)[C@H](C2CCN(S(C)(=O)=O)CC2)[C@@](C)(c2cc(-c3cncnc3)cs2)N=C1N
InChIInChI=1S/C23H28N4O3S.C22H18ClN5O2S.2C20H26N6O3S2.C17H19FN4O2S/c1-2-31(29,30)26-15-13-18(14-16-26)17-27-21(28)23(25-22(27)24,19-9-5-3-6-10-19)20-11-7-4-8-12-20;1-22(17-10-14(11-31-17)15-4-6-18(23)27-26-15)19(20(29)28(2)21(24)25-22)13-3-5-16-12(9-13)7-8-30-16;2*1-20(16-8-14(11-30-16)15-9-22-12-23-10-15)17(18(27)25(2)19(21)24-20)13-4-6-26(7-5-13)31(3,28)29;1-4-24-12-6-10(5-11(18)7-12)13-9-20-15(25-13)17(2)8-14(23)22(3)16(19)21-17/h3-12,18H,2,13-17H2,1H3,(H2,24,25);3-11,19H,1-2H3,(H2,24,25);2*8-13,17H,4-7H2,1-3H3,(H2,21,24);5-7,9H,4,8H2,1-3H3,(H2,19,21)/t;19?,22-;17-,20+;17-,20-;17-/m.1010/s1
InChIKeyMSAWXAXQSYAGSV-PYNLHRRBSA-N
MW2180.14 g/mol
LogP12.27
Rot. Bonds21

About (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one

(6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one (PubChem CID 159654898) has the molecular formula C102H117ClFN25O13S7 and a molecular weight of 2180.14 g/mol. Its IUPAC name is (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one.

Molecular Properties

Compound Name(6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one
PubChem CID159654898
Molecular FormulaC102H117ClFN25O13S7
Molecular Weight2180.14 g/mol
Exact Mass2177.70
IUPAC Name(6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one
SMILESCCOc1cc(F)cc(-c2cnc([C@]3(C)CC(=O)N(C)C(N)=N3)s2)c1.CCS(=O)(=O)N1CCC(CN2C(=O)C(c3ccccc3)(c3ccccc3)N=C2N)CC1.CN1C(=O)C(c2ccc3occc3c2)[C@@](C)(c2cc(-c3ccc(Cl)nn3)cs2)N=C1N.CN1C(=O)[C@@H](C2CCN(S(C)(=O)=O)CC2)[C@@](C)(c2cc(-c3cncnc3)cs2)N=C1N.CN1C(=O)[C@H](C2CCN(S(C)(=O)=O)CC2)[C@@](C)(c2cc(-c3cncnc3)cs2)N=C1N
InChIInChI=1S/C23H28N4O3S.C22H18ClN5O2S.2C20H26N6O3S2.C17H19FN4O2S/c1-2-31(29,30)26-15-13-18(14-16-26)17-27-21(28)23(25-22(27)24,19-9-5-3-6-10-19)20-11-7-4-8-12-20;1-22(17-10-14(11-31-17)15-4-6-18(23)27-26-15)19(20(29)28(2)21(24)25-22)13-3-5-16-12(9-13)7-8-30-16;2*1-20(16-8-14(11-30-16)15-9-22-12-23-10-15)17(18(27)25(2)19(21)24-20)13-4-6-26(7-5-13)31(3,28)29;1-4-24-12-6-10(5-11(18)7-12)13-9-20-15(25-13)17(2)8-14(23)22(3)16(19)21-17/h3-12,18H,2,13-17H2,1H3,(H2,24,25);3-11,19H,1-2H3,(H2,24,25);2*8-13,17H,4-7H2,1-3H3,(H2,21,24);5-7,9H,4,8H2,1-3H3,(H2,19,21)/t;19?,22-;17-,20+;17-,20-;17-/m.1010/s1
InChIKeyMSAWXAXQSYAGSV-PYNLHRRBSA-N
XLogP12.27
TPSA518.19 Ų
H-Bond Donors5
H-Bond Acceptors34
Rotatable Bonds21
Heavy Atoms149
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002180.14
LogP ≤ 512.27
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1034

Analyze (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one with MolForge

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Related Compounds

(6S)-2-amino-5-(1-benzofuran-5-yl)-3,6-dimethyl-6-[4-(6-methylpyridazin-3-yl)thiophen-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-chlorophenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;5-[(4S)-2-amino-5-[4-(1,1-difluoroethyl)phenyl]-4-methyl-6-oxo-1,5-dihydropyrimidin-4-yl]thiophene-2-carbonitrile;5-[2-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1,3-thiazol-4-yl]-2-fluorobenzonitrile;2-amino-5-[3-[(2-ethylpyrazol-3-yl)amino]phenyl]-3-methyl-5-phenylimidazol-4-one
CID 158409107
3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-[5-[2-[(1,3-benzothiazol-6-ylamino)methyl]-5-methoxyphenyl]cyclohexa-1,3-dien-1-yl]-5-methylimidazol-4-one;(6S)-2-amino-5-(1-benzofuran-5-yl)-3,6-dimethyl-6-[4-(6-methylpyridazin-3-yl)thiophen-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-chlorophenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;5-[2-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-1,3-thiazol-4-yl]-2-fluorobenzonitrile;2-amino-5-[3-[(2-ethylpyrazol-3-yl)amino]phenyl]-3-methyl-5-phenylimidazol-4-one
CID 157172533
7-N-[(5-acetylthiophen-2-yl)methyl]-5-N-[(3-chloro-4-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(5-acetylthiophen-2-yl)methyl]-5-N-[(3,4-difluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(5-acetylthiophen-3-yl)methyl]-5-N-[(4-fluoro-3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-(1-benzofuran-5-ylmethyl)-5-N-[(4-fluoro-3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;5-N-[(4-fluoro-3-methylphenyl)methyl]-7-N-[(5-propanoylthiophen-3-yl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 158094437
(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one
CID 158454352

Frequently Asked Questions

What is the IUPAC name of (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one?
The IUPAC name of (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one (CID 159654898) is (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one.
What is the SMILES notation for (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one?
The canonical SMILES for (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one is CCOc1cc(F)cc(-c2cnc([C@]3(C)CC(=O)N(C)C(N)=N3)s2)c1.CCS(=O)(=O)N1CCC(CN2C(=O)C(c3ccccc3)(c3ccccc3)N=C2N)CC1.CN1C(=O)C(c2ccc3occc3c2)[C@@](C)(c2cc(-c3ccc(Cl)nn3)cs2)N=C1N.CN1C(=O)[C@@H](C2CCN(S(C)(=O)=O)CC2)[C@@](C)(c2cc(-c3cncnc3)cs2)N=C1N.CN1C(=O)[C@H](C2CCN(S(C)(=O)=O)CC2)[C@@](C)(c2cc(-c3cncnc3)cs2)N=C1N.
What is the InChIKey of (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one?
The InChIKey is MSAWXAXQSYAGSV-PYNLHRRBSA-N. The full InChI is InChI=1S/C23H28N4O3S.C22H18ClN5O2S.2C20H26N6O3S2.C17H19FN4O2S/c1-2-31(29,30)26-15-13-18(14-16-26)17-27-21(28)23(25-22(27)24,19-9-5-3-6-10-19)20-11-7-4-8-12-20;1-22(17-10-14(11-31-17)15-4-6-18(23)27-26-15)19(20(29)28(2)21(24)25-22)13-3-5-16-12(9-13)7-8-30-16;2*1-20(16-8-14(11-30-16)15-9-22-12-23-10-15)17(18(27)25(2)19(21)24-20)13-4-6-26(7-5-13)31(3,28)29;1-4-24-12-6-10(5-11(18)7-12)13-9-20-15(25-13)17(2)8-14(23)22(3)16(19)21-17/h3-12,18H,2,13-17H2,1H3,(H2,24,25);3-11,19H,1-2H3,(H2,24,25);2*8-13,17H,4-7H2,1-3H3,(H2,21,24);5-7,9H,4,8H2,1-3H3,(H2,19,21)/t;19?,22-;17-,20+;17-,20-;17-/m.1010/s1.
What are the key properties of (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one?
(6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one has a molecular weight of 2180.14 g/mol, XLogP of 12.27, 21 rotatable bonds, 5 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-2-amino-5-(1-benzofuran-5-yl)-6-[4-(6-chloropyridazin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(5S,6S)-2-amino-3,6-dimethyl-5-(1-methylsulfonylpiperidin-4-yl)-6-(4-pyrimidin-5-ylthiophen-2-yl)-5H-pyrimidin-4-one;(6S)-2-amino-6-[5-(3-ethoxy-5-fluorophenyl)-1,3-thiazol-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one;2-amino-3-[(1-ethylsulfonylpiperidin-4-yl)methyl]-5,5-diphenylimidazol-4-one is sourced from PubChem (CID 159654898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).