N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide

C131H143Br2ClFN29O9S3 — CID 162234239

IUPACN-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide
SMILESCC(=O)NCCN1C(=O)C[C@@](C)(c2ccc3sccc3c2)N=C1N.CC(=O)Nc1cccc(-c2cc([C@]3(C)CC(=O)N(C)C(N)=N3)ccn2)c1.CN1C(=O)C[C@@](C)(c2ccnc(-c3ccc(F)c(Cl)c3)c2)N=C1N.CN1C(=O)[C@@H](c2ccc(C(C)(C)C)cc2)[C@@](C)(c2cccc(-c3cncc(C#N)c3)c2)N=C1N.CN1C(=O)[C@H](c2ccc(C(C)(C)C)cc2)[C@@](C)(c2cccc(-c3cncc(C#N)c3)c2)N=C1N.C[C@@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(Br)cs1.C[C@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(Br)cs1
InChIInChI=1S/2C28H29N5O.C19H21N5O2.C17H16ClFN4O.C17H20N4O2S.2C11H14BrN3OS/c2*1-27(2,3)22-11-9-19(10-12-22)24-25(34)33(5)26(30)32-28(24,4)23-8-6-7-20(14-23)21-13-18(15-29)16-31-17-21;1-12(25)22-15-6-4-5-13(9-15)16-10-14(7-8-21-16)19(2)11-17(26)24(3)18(20)23-19;1-17(9-15(24)23(2)16(20)22-17)11-5-6-21-14(8-11)10-3-4-13(19)12(18)7-10;1-11(22)19-6-7-21-15(23)10-17(2,20-16(21)18)13-3-4-14-12(9-13)5-8-24-14;2*1-6-9(16)15(3)10(13)14-11(6,2)8-4-7(12)5-17-8/h2*6-14,16-17,24H,1-5H3,(H2,30,32);4-10H,11H2,1-3H3,(H2,20,23)(H,22,25);3-8H,9H2,1-2H3,(H2,20,22);3-5,8-9H,6-7,10H2,1-2H3,(H2,18,20)(H,19,22);2*4-6H,1-3H3,(H2,13,14)/t24-,28+;24-,28-;19-;2*17-;6-,11+;6-,11-/m0100010/s1
InChIKeyZVVRJAUNIBYIPR-QFYNGAGNSA-N
MW2578.24 g/mol
LogP20.54
Rot. Bonds17

About N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide

N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide (PubChem CID 162234239) has the molecular formula C131H143Br2ClFN29O9S3 and a molecular weight of 2578.24 g/mol. Its IUPAC name is N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide
PubChem CID162234239
Molecular FormulaC131H143Br2ClFN29O9S3
Molecular Weight2578.24 g/mol
Exact Mass2573.88
IUPAC NameN-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide
SMILESCC(=O)NCCN1C(=O)C[C@@](C)(c2ccc3sccc3c2)N=C1N.CC(=O)Nc1cccc(-c2cc([C@]3(C)CC(=O)N(C)C(N)=N3)ccn2)c1.CN1C(=O)C[C@@](C)(c2ccnc(-c3ccc(F)c(Cl)c3)c2)N=C1N.CN1C(=O)[C@@H](c2ccc(C(C)(C)C)cc2)[C@@](C)(c2cccc(-c3cncc(C#N)c3)c2)N=C1N.CN1C(=O)[C@H](c2ccc(C(C)(C)C)cc2)[C@@](C)(c2cccc(-c3cncc(C#N)c3)c2)N=C1N.C[C@@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(Br)cs1.C[C@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(Br)cs1
InChIInChI=1S/2C28H29N5O.C19H21N5O2.C17H16ClFN4O.C17H20N4O2S.2C11H14BrN3OS/c2*1-27(2,3)22-11-9-19(10-12-22)24-25(34)33(5)26(30)32-28(24,4)23-8-6-7-20(14-23)21-13-18(15-29)16-31-17-21;1-12(25)22-15-6-4-5-13(9-15)16-10-14(7-8-21-16)19(2)11-17(26)24(3)18(20)23-19;1-17(9-15(24)23(2)16(20)22-17)11-5-6-21-14(8-11)10-3-4-13(19)12(18)7-10;1-11(22)19-6-7-21-15(23)10-17(2,20-16(21)18)13-3-4-14-12(9-13)5-8-24-14;2*1-6-9(16)15(3)10(13)14-11(6,2)8-4-7(12)5-17-8/h2*6-14,16-17,24H,1-5H3,(H2,30,32);4-10H,11H2,1-3H3,(H2,20,23)(H,22,25);3-8H,9H2,1-2H3,(H2,20,22);3-5,8-9H,6-7,10H2,1-2H3,(H2,18,20)(H,19,22);2*4-6H,1-3H3,(H2,13,14)/t24-,28+;24-,28-;19-;2*17-;6-,11+;6-,11-/m0100010/s1
InChIKeyZVVRJAUNIBYIPR-QFYNGAGNSA-N
XLogP20.54
TPSA568.17 Ų
H-Bond Donors9
H-Bond Acceptors32
Rotatable Bonds17
Heavy Atoms176
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002578.24
LogP ≤ 520.54
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1032

Analyze N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide?
The IUPAC name of N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide (CID 162234239) is N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide.
What is the SMILES notation for N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide?
The canonical SMILES for N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide is CC(=O)NCCN1C(=O)C[C@@](C)(c2ccc3sccc3c2)N=C1N.CC(=O)Nc1cccc(-c2cc([C@]3(C)CC(=O)N(C)C(N)=N3)ccn2)c1.CN1C(=O)C[C@@](C)(c2ccnc(-c3ccc(F)c(Cl)c3)c2)N=C1N.CN1C(=O)[C@@H](c2ccc(C(C)(C)C)cc2)[C@@](C)(c2cccc(-c3cncc(C#N)c3)c2)N=C1N.CN1C(=O)[C@H](c2ccc(C(C)(C)C)cc2)[C@@](C)(c2cccc(-c3cncc(C#N)c3)c2)N=C1N.C[C@@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(Br)cs1.C[C@H]1C(=O)N(C)C(N)=N[C@]1(C)c1cc(Br)cs1.
What is the InChIKey of N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide?
The InChIKey is ZVVRJAUNIBYIPR-QFYNGAGNSA-N. The full InChI is InChI=1S/2C28H29N5O.C19H21N5O2.C17H16ClFN4O.C17H20N4O2S.2C11H14BrN3OS/c2*1-27(2,3)22-11-9-19(10-12-22)24-25(34)33(5)26(30)32-28(24,4)23-8-6-7-20(14-23)21-13-18(15-29)16-31-17-21;1-12(25)22-15-6-4-5-13(9-15)16-10-14(7-8-21-16)19(2)11-17(26)24(3)18(20)23-19;1-17(9-15(24)23(2)16(20)22-17)11-5-6-21-14(8-11)10-3-4-13(19)12(18)7-10;1-11(22)19-6-7-21-15(23)10-17(2,20-16(21)18)13-3-4-14-12(9-13)5-8-24-14;2*1-6-9(16)15(3)10(13)14-11(6,2)8-4-7(12)5-17-8/h2*6-14,16-17,24H,1-5H3,(H2,30,32);4-10H,11H2,1-3H3,(H2,20,23)(H,22,25);3-8H,9H2,1-2H3,(H2,20,22);3-5,8-9H,6-7,10H2,1-2H3,(H2,18,20)(H,19,22);2*4-6H,1-3H3,(H2,13,14)/t24-,28+;24-,28-;19-;2*17-;6-,11+;6-,11-/m0100010/s1.
What are the key properties of N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide?
N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide has a molecular weight of 2578.24 g/mol, XLogP of 20.54, 17 rotatable bonds, 9 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4S)-2-amino-4-(1-benzothiophen-5-yl)-4-methyl-6-oxo-5H-pyrimidin-1-yl]ethyl]acetamide;(5S,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-(4-bromothiophen-2-yl)-3,5,6-trimethyl-5H-pyrimidin-4-one;5-[3-[(4S,5S)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;5-[3-[(4S,5R)-2-amino-5-(4-tert-butylphenyl)-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]pyridine-3-carbonitrile;(6S)-2-amino-6-[2-(3-chloro-4-fluorophenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;N-[3-[4-[(4S)-2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]-2-pyridinyl]phenyl]acetamide is sourced from PubChem (CID 162234239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).