8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one

C122H130F3N29O5 — CID 161426794

IUPAC8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one
SMILESCC#Cc1cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n(C(F)(F)F)c1=O.CC(C)C#Cc1cc2cnc(Nc3ccc(NC4CCCNC4)cc3)nc2n(Cc2cccnc2CCN(C)C)c1=O.CCOC#Cc1cc2cnc(Nc3ccc(NC4CCNCC4)cc3)nc2n(Cc2cncnc2-c2ccccc2)c1=O.Cc1cc(Nc2ncc3cc(C#CC4CC4)c(=O)n(Cc4cnccc4C4CCCC4)c3n2)ccc1N1CCNCC1
InChIInChI=1S/C34H37N7O.C33H32N8O2.C33H40N8O.C22H21F3N6O/c1-23-18-29(10-11-31(23)40-16-14-35-15-17-40)38-34-37-21-27-19-26(9-8-24-6-7-24)33(42)41(32(27)39-34)22-28-20-36-13-12-30(28)25-4-2-3-5-25;1-2-43-17-14-24-18-25-20-36-33(39-28-10-8-27(9-11-28)38-29-12-15-34-16-13-29)40-31(25)41(32(24)42)21-26-19-35-22-37-30(26)23-6-4-3-5-7-23;1-23(2)9-10-24-19-26-20-36-33(38-28-13-11-27(12-14-28)37-29-8-6-16-34-21-29)39-31(26)41(32(24)42)22-25-7-5-17-35-30(25)15-18-40(3)4;1-3-4-15-13-16-14-26-21(28-19(16)31(20(15)32)22(23,24)25)27-17-5-7-18(8-6-17)30-11-9-29(2)10-12-30/h10-13,18-21,24-25,35H,2-7,14-17,22H2,1H3,(H,37,38,39);3-11,18-20,22,29,34,38H,2,12-13,15-16,21H2,1H3,(H,36,39,40);5,7,11-14,17,19-20,23,29,34,37H,6,8,15-16,18,21-22H2,1-4H3,(H,36,38,39);5-8,13-14H,9-12H2,1-2H3,(H,26,27,28)
InChIKeyVXLQZHHECYAFSV-UHFFFAOYSA-N
MW2139.57 g/mol
LogP17.05
Rot. Bonds26

About 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one

8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one (PubChem CID 161426794) has the molecular formula C122H130F3N29O5 and a molecular weight of 2139.57 g/mol. Its IUPAC name is 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one
PubChem CID161426794
Molecular FormulaC122H130F3N29O5
Molecular Weight2139.57 g/mol
Exact Mass2138.08
IUPAC Name8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one
SMILESCC#Cc1cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n(C(F)(F)F)c1=O.CC(C)C#Cc1cc2cnc(Nc3ccc(NC4CCCNC4)cc3)nc2n(Cc2cccnc2CCN(C)C)c1=O.CCOC#Cc1cc2cnc(Nc3ccc(NC4CCNCC4)cc3)nc2n(Cc2cncnc2-c2ccccc2)c1=O.Cc1cc(Nc2ncc3cc(C#CC4CC4)c(=O)n(Cc4cnccc4C4CCCC4)c3n2)ccc1N1CCNCC1
InChIInChI=1S/C34H37N7O.C33H32N8O2.C33H40N8O.C22H21F3N6O/c1-23-18-29(10-11-31(23)40-16-14-35-15-17-40)38-34-37-21-27-19-26(9-8-24-6-7-24)33(42)41(32(27)39-34)22-28-20-36-13-12-30(28)25-4-2-3-5-25;1-2-43-17-14-24-18-25-20-36-33(39-28-10-8-27(9-11-28)38-29-12-15-34-16-13-29)40-31(25)41(32(24)42)21-26-19-35-22-37-30(26)23-6-4-3-5-7-23;1-23(2)9-10-24-19-26-20-36-33(38-28-13-11-27(12-14-28)37-29-8-6-16-34-21-29)39-31(26)41(32(24)42)22-25-7-5-17-35-30(25)15-18-40(3)4;1-3-4-15-13-16-14-26-21(28-19(16)31(20(15)32)22(23,24)25)27-17-5-7-18(8-6-17)30-11-9-29(2)10-12-30/h10-13,18-21,24-25,35H,2-7,14-17,22H2,1H3,(H,37,38,39);3-11,18-20,22,29,34,38H,2,12-13,15-16,21H2,1H3,(H,36,39,40);5,7,11-14,17,19-20,23,29,34,37H,6,8,15-16,18,21-22H2,1-4H3,(H,36,38,39);5-8,13-14H,9-12H2,1-2H3,(H,26,27,28)
InChIKeyVXLQZHHECYAFSV-UHFFFAOYSA-N
XLogP17.05
TPSA373.14 Ų
H-Bond Donors9
H-Bond Acceptors34
Rotatable Bonds26
Heavy Atoms159
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002139.57
LogP ≤ 517.05
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one with MolForge

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Related Compounds

1-[4-[9-(2-aminopyrimidin-5-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-(trifluoromethyl)phenyl]-N-(1-methylpiperidin-4-yl)piperidine-4-carboxamide
CID 58525149
(E)-N-[4-[2-[4-[2-[2-[[(Z)-5-[4-[2-[4-[2-(2-aminopyrimidin-5-yl)-6-morpholin-4-yl-4-pyridinyl]piperazin-1-yl]-2-oxoethyl]anilino]-5-oxo-3-(trifluoromethyl)pent-3-en-2-yl]amino]pyrimidin-5-yl]-6-morpholin-4-yl-4-pyridinyl]piperazin-1-yl]-2-oxoethyl]phenyl]-4-methyl-3-(trifluoromethyl)pent-2-enamide
CID 88970843
(E)-N-[4-[2-[4-[2-[2-[[(E)-5-[4-[2-[4-[2-(2-aminopyrimidin-5-yl)-6-morpholin-4-yl-4-pyridinyl]piperazin-1-yl]-2-oxoethyl]anilino]-3-methyl-5-oxopent-3-en-2-yl]amino]pyrimidin-5-yl]-6-morpholin-4-yl-4-pyridinyl]piperazin-1-yl]-2-oxoethyl]phenyl]-4-methyl-3-(trifluoromethyl)pent-2-enamide
CID 88970848
6-[3-Methyl-5-(1-methylpiperidin-4-yl)-2-pyridinyl]-2-[4-piperazin-1-yl-3-(trifluoromethyl)anilino]-8-[[2-(trifluoromethyl)phenyl]methyl]pyrido[2,3-d]pyrimidin-7-one
CID 89113838
8-[(4-Cyclopropylpyrimidin-5-yl)methyl]-6-pentan-3-yl-2-[4-piperazin-1-yl-3-(trifluoromethyl)anilino]pyrido[2,3-d]pyrimidin-7-one
CID 89631654
6-Pentan-3-yl-2-[4-piperazin-1-yl-3-(trifluoromethyl)anilino]-8-[(1-pyridin-4-ylpyrrol-2-yl)methyl]pyrido[2,3-d]pyrimidin-7-one
CID 89631726
6-(2-Ethoxyethynyl)-8-[(3-ethylpyridin-2-yl)methyl]-2-[4-piperazin-1-yl-3-(trifluoromethyl)anilino]pyrido[2,3-d]pyrimidin-7-one
CID 89632959
6-[2-(1-Methylpiperidin-4-yl)ethynyl]-2-[4-(piperidin-3-ylamino)anilino]-8-[[4-(2,2,2-trifluoroethyl)pyrimidin-5-yl]methyl]pyrido[2,3-d]pyrimidin-7-one
CID 89632978
8-[(2-cyclopentylphenyl)methyl]-2-[4-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-3-fluoroanilino]-6-[3-(2-fluorophenyl)prop-1-ynyl]pyrido[2,3-d]pyrimidin-7-one
CID 89633020
6-[2-(Cyclopenten-1-yl)ethynyl]-8-[(2-fluoro-6-pyridin-4-ylphenyl)methyl]-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one
CID 89633075
6-[2-(Diethylamino)ethynyl]-8-[[2-(oxan-4-yl)phenyl]methyl]-2-[4-piperazin-1-yl-3-(trifluoromethyl)anilino]pyrido[2,3-d]pyrimidin-7-one
CID 89633090
2-[4-(1-Methylpiperidin-4-yl)anilino]-6-[2-(oxan-2-yl)ethynyl]-8-[[3-(2,2,2-trifluoroethyl)pyridin-2-yl]methyl]pyrido[2,3-d]pyrimidin-7-one
CID 89633189

Frequently Asked Questions

What is the IUPAC name of 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one (CID 161426794) is 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one is CC#Cc1cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n(C(F)(F)F)c1=O.CC(C)C#Cc1cc2cnc(Nc3ccc(NC4CCCNC4)cc3)nc2n(Cc2cccnc2CCN(C)C)c1=O.CCOC#Cc1cc2cnc(Nc3ccc(NC4CCNCC4)cc3)nc2n(Cc2cncnc2-c2ccccc2)c1=O.Cc1cc(Nc2ncc3cc(C#CC4CC4)c(=O)n(Cc4cnccc4C4CCCC4)c3n2)ccc1N1CCNCC1.
What is the InChIKey of 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is VXLQZHHECYAFSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H37N7O.C33H32N8O2.C33H40N8O.C22H21F3N6O/c1-23-18-29(10-11-31(23)40-16-14-35-15-17-40)38-34-37-21-27-19-26(9-8-24-6-7-24)33(42)41(32(27)39-34)22-28-20-36-13-12-30(28)25-4-2-3-5-25;1-2-43-17-14-24-18-25-20-36-33(39-28-10-8-27(9-11-28)38-29-12-15-34-16-13-29)40-31(25)41(32(24)42)21-26-19-35-22-37-30(26)23-6-4-3-5-7-23;1-23(2)9-10-24-19-26-20-36-33(38-28-13-11-27(12-14-28)37-29-8-6-16-34-21-29)39-31(26)41(32(24)42)22-25-7-5-17-35-30(25)15-18-40(3)4;1-3-4-15-13-16-14-26-21(28-19(16)31(20(15)32)22(23,24)25)27-17-5-7-18(8-6-17)30-11-9-29(2)10-12-30/h10-13,18-21,24-25,35H,2-7,14-17,22H2,1H3,(H,37,38,39);3-11,18-20,22,29,34,38H,2,12-13,15-16,21H2,1H3,(H,36,39,40);5,7,11-14,17,19-20,23,29,34,37H,6,8,15-16,18,21-22H2,1-4H3,(H,36,38,39);5-8,13-14H,9-12H2,1-2H3,(H,26,27,28).
What are the key properties of 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one?
8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 2139.57 g/mol, XLogP of 17.05, 26 rotatable bonds, 9 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(4-cyclopentyl-3-pyridinyl)methyl]-6-(2-cyclopropylethynyl)-2-(3-methyl-4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[2-[2-(dimethylamino)ethyl]-3-pyridinyl]methyl]-6-(3-methylbut-1-ynyl)-2-[4-(piperidin-3-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;6-(2-ethoxyethynyl)-8-[(4-phenylpyrimidin-5-yl)methyl]-2-[4-(piperidin-4-ylamino)anilino]pyrido[2,3-d]pyrimidin-7-one;2-[4-(4-methylpiperazin-1-yl)anilino]-6-prop-1-ynyl-8-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 161426794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).