6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one

C256H260Cl9N53O16 — CID 158254174

IUPAC6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one
SMILESCCNc1ncc2cc(-c3ccc(-c4ncccc4C)cc3Cl)c(=O)n(CC)c2n1.CCn1c(=O)c(-c2ccc(-c3cccc(C)n3)cc2Cl)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3cccc(C)n3)cc2Cl)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2C)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NC3CCCCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NC3CCN(C)CC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NCCN(C)C)nc21.CCn1c(=O)c(-c2ccc(-c3nccnc3C)cc2Cl)cc2cnc(NC3CCOCC3)nc21.Cc1cccnc1-c1ccc(-c2cc3cnc(NC4CCOCC4)nc3[nH]c2=O)c(Cl)c1
InChIInChI=1S/C27H29ClN6O.C27H28ClN5O.C27H29N5O2.3C26H26ClN5O2.C25H25ClN6O2.C25H27ClN6O.C24H22ClN5O2.C23H22ClN5O/c1-4-34-25-19(16-30-27(32-25)31-20-9-12-33(3)13-10-20)14-22(26(34)35)21-8-7-18(15-23(21)28)24-17(2)6-5-11-29-24;1-3-33-25-19(16-30-27(32-25)31-20-9-5-4-6-10-20)14-22(26(33)34)21-12-11-18(15-23(21)28)24-17(2)8-7-13-29-24;1-4-32-25-20(16-29-27(31-25)30-21-9-12-34-13-10-21)15-23(26(32)33)22-8-7-19(14-18(22)3)24-17(2)6-5-11-28-24;1-3-32-24-18(15-29-26(31-24)30-19-8-11-34-12-9-19)13-21(25(32)33)20-7-6-17(14-22(20)27)23-16(2)5-4-10-28-23;2*1-3-32-24-18(15-28-26(31-24)30-19-9-11-34-12-10-19)13-21(25(32)33)20-8-7-17(14-22(20)27)23-6-4-5-16(2)29-23;1-3-32-23-17(14-29-25(31-23)30-18-6-10-34-11-7-18)12-20(24(32)33)19-5-4-16(13-21(19)26)22-15(2)27-8-9-28-22;1-5-32-23-18(15-29-25(30-23)28-11-12-31(3)4)13-20(24(32)33)19-9-8-17(14-21(19)26)22-16(2)7-6-10-27-22;1-14-3-2-8-26-21(14)15-4-5-18(20(25)12-15)19-11-16-13-27-24(30-22(16)29-23(19)31)28-17-6-9-32-10-7-17;1-4-25-23-27-13-16-11-18(22(30)29(5-2)21(16)28-23)17-9-8-15(12-19(17)24)20-14(3)7-6-10-26-20/h5-8,11,14-16,20H,4,9-10,12-13H2,1-3H3,(H,30,31,32);7-8,11-16,20H,3-6,9-10H2,1-2H3,(H,30,31,32);5-8,11,14-16,21H,4,9-10,12-13H2,1-3H3,(H,29,30,31);4-7,10,13-15,19H,3,8-9,11-12H2,1-2H3,(H,29,30,31);2*4-8,13-15,19H,3,9-12H2,1-2H3,(H,28,30,31);4-5,8-9,12-14,18H,3,6-7,10-11H2,1-2H3,(H,29,30,31);6-10,13-15H,5,11-12H2,1-4H3,(H,28,29,30);2-5,8,11-13,17H,6-7,9-10H2,1H3,(H2,27,28,29,30,31);6-13H,4-5H2,1-3H3,(H,25,27,28)
InChIKeyGHBOUECEYGZVDT-UHFFFAOYSA-N
MW4654.33 g/mol
LogP49.78
Rot. Bonds51

About 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one

6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one (PubChem CID 158254174) has the molecular formula C256H260Cl9N53O16 and a molecular weight of 4654.33 g/mol. Its IUPAC name is 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one
PubChem CID158254174
Molecular FormulaC256H260Cl9N53O16
Molecular Weight4654.33 g/mol
Exact Mass4646.84
IUPAC Name6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one
SMILESCCNc1ncc2cc(-c3ccc(-c4ncccc4C)cc3Cl)c(=O)n(CC)c2n1.CCn1c(=O)c(-c2ccc(-c3cccc(C)n3)cc2Cl)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3cccc(C)n3)cc2Cl)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2C)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NC3CCCCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NC3CCN(C)CC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NCCN(C)C)nc21.CCn1c(=O)c(-c2ccc(-c3nccnc3C)cc2Cl)cc2cnc(NC3CCOCC3)nc21.Cc1cccnc1-c1ccc(-c2cc3cnc(NC4CCOCC4)nc3[nH]c2=O)c(Cl)c1
InChIInChI=1S/C27H29ClN6O.C27H28ClN5O.C27H29N5O2.3C26H26ClN5O2.C25H25ClN6O2.C25H27ClN6O.C24H22ClN5O2.C23H22ClN5O/c1-4-34-25-19(16-30-27(32-25)31-20-9-12-33(3)13-10-20)14-22(26(34)35)21-8-7-18(15-23(21)28)24-17(2)6-5-11-29-24;1-3-33-25-19(16-30-27(32-25)31-20-9-5-4-6-10-20)14-22(26(33)34)21-12-11-18(15-23(21)28)24-17(2)8-7-13-29-24;1-4-32-25-20(16-29-27(31-25)30-21-9-12-34-13-10-21)15-23(26(32)33)22-8-7-19(14-18(22)3)24-17(2)6-5-11-28-24;1-3-32-24-18(15-29-26(31-24)30-19-8-11-34-12-9-19)13-21(25(32)33)20-7-6-17(14-22(20)27)23-16(2)5-4-10-28-23;2*1-3-32-24-18(15-28-26(31-24)30-19-9-11-34-12-10-19)13-21(25(32)33)20-8-7-17(14-22(20)27)23-6-4-5-16(2)29-23;1-3-32-23-17(14-29-25(31-23)30-18-6-10-34-11-7-18)12-20(24(32)33)19-5-4-16(13-21(19)26)22-15(2)27-8-9-28-22;1-5-32-23-18(15-29-25(30-23)28-11-12-31(3)4)13-20(24(32)33)19-9-8-17(14-21(19)26)22-16(2)7-6-10-27-22;1-14-3-2-8-26-21(14)15-4-5-18(20(25)12-15)19-11-16-13-27-24(30-22(16)29-23(19)31)28-17-6-9-32-10-7-17;1-4-25-23-27-13-16-11-18(22(30)29(5-2)21(16)28-23)17-9-8-15(12-19(17)24)20-14(3)7-6-10-26-20/h5-8,11,14-16,20H,4,9-10,12-13H2,1-3H3,(H,30,31,32);7-8,11-16,20H,3-6,9-10H2,1-2H3,(H,30,31,32);5-8,11,14-16,21H,4,9-10,12-13H2,1-3H3,(H,29,30,31);4-7,10,13-15,19H,3,8-9,11-12H2,1-2H3,(H,29,30,31);2*4-8,13-15,19H,3,9-12H2,1-2H3,(H,28,30,31);4-5,8-9,12-14,18H,3,6-7,10-11H2,1-2H3,(H,29,30,31);6-10,13-15H,5,11-12H2,1-4H3,(H,28,29,30);2-5,8,11-13,17H,6-7,9-10H2,1H3,(H2,27,28,29,30,31);6-13H,4-5H2,1-3H3,(H,25,27,28)
InChIKeyGHBOUECEYGZVDT-UHFFFAOYSA-N
XLogP49.78
TPSA812.61 Ų
H-Bond Donors11
H-Bond Acceptors68
Rotatable Bonds51
Heavy Atoms334
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004654.33
LogP ≤ 549.78
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1068

Analyze 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one (CID 158254174) is 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one is CCNc1ncc2cc(-c3ccc(-c4ncccc4C)cc3Cl)c(=O)n(CC)c2n1.CCn1c(=O)c(-c2ccc(-c3cccc(C)n3)cc2Cl)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3cccc(C)n3)cc2Cl)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2C)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NC3CCCCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NC3CCN(C)CC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NC3CCOCC3)nc21.CCn1c(=O)c(-c2ccc(-c3ncccc3C)cc2Cl)cc2cnc(NCCN(C)C)nc21.CCn1c(=O)c(-c2ccc(-c3nccnc3C)cc2Cl)cc2cnc(NC3CCOCC3)nc21.Cc1cccnc1-c1ccc(-c2cc3cnc(NC4CCOCC4)nc3[nH]c2=O)c(Cl)c1.
What is the InChIKey of 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is GHBOUECEYGZVDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29ClN6O.C27H28ClN5O.C27H29N5O2.3C26H26ClN5O2.C25H25ClN6O2.C25H27ClN6O.C24H22ClN5O2.C23H22ClN5O/c1-4-34-25-19(16-30-27(32-25)31-20-9-12-33(3)13-10-20)14-22(26(34)35)21-8-7-18(15-23(21)28)24-17(2)6-5-11-29-24;1-3-33-25-19(16-30-27(32-25)31-20-9-5-4-6-10-20)14-22(26(33)34)21-12-11-18(15-23(21)28)24-17(2)8-7-13-29-24;1-4-32-25-20(16-29-27(31-25)30-21-9-12-34-13-10-21)15-23(26(32)33)22-8-7-19(14-18(22)3)24-17(2)6-5-11-28-24;1-3-32-24-18(15-29-26(31-24)30-19-8-11-34-12-9-19)13-21(25(32)33)20-7-6-17(14-22(20)27)23-16(2)5-4-10-28-23;2*1-3-32-24-18(15-28-26(31-24)30-19-9-11-34-12-10-19)13-21(25(32)33)20-8-7-17(14-22(20)27)23-6-4-5-16(2)29-23;1-3-32-23-17(14-29-25(31-23)30-18-6-10-34-11-7-18)12-20(24(32)33)19-5-4-16(13-21(19)26)22-15(2)27-8-9-28-22;1-5-32-23-18(15-29-25(30-23)28-11-12-31(3)4)13-20(24(32)33)19-9-8-17(14-21(19)26)22-16(2)7-6-10-27-22;1-14-3-2-8-26-21(14)15-4-5-18(20(25)12-15)19-11-16-13-27-24(30-22(16)29-23(19)31)28-17-6-9-32-10-7-17;1-4-25-23-27-13-16-11-18(22(30)29(5-2)21(16)28-23)17-9-8-15(12-19(17)24)20-14(3)7-6-10-26-20/h5-8,11,14-16,20H,4,9-10,12-13H2,1-3H3,(H,30,31,32);7-8,11-16,20H,3-6,9-10H2,1-2H3,(H,30,31,32);5-8,11,14-16,21H,4,9-10,12-13H2,1-3H3,(H,29,30,31);4-7,10,13-15,19H,3,8-9,11-12H2,1-2H3,(H,29,30,31);2*4-8,13-15,19H,3,9-12H2,1-2H3,(H,28,30,31);4-5,8-9,12-14,18H,3,6-7,10-11H2,1-2H3,(H,29,30,31);6-10,13-15H,5,11-12H2,1-4H3,(H,28,29,30);2-5,8,11-13,17H,6-7,9-10H2,1H3,(H2,27,28,29,30,31);6-13H,4-5H2,1-3H3,(H,25,27,28).
What are the key properties of 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one?
6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 4654.33 g/mol, XLogP of 49.78, 51 rotatable bonds, 11 hydrogen bond donors, and 68 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-chloro-4-(3-methylpyrazin-2-yl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(cyclohexylamino)-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-[2-(dimethylamino)ethylamino]-8-ethylpyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(ethylamino)pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-[(1-methylpiperidin-4-yl)amino]pyrido[2,3-d]pyrimidin-7-one;6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one;bis(6-[2-chloro-4-(6-methyl-2-pyridinyl)phenyl]-8-ethyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one);6-[2-chloro-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one;8-ethyl-6-[2-methyl-4-(3-methyl-2-pyridinyl)phenyl]-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 158254174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).