2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide

C155H169ClFN39O21S4 — CID 161220951

About 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide

2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide (PubChem CID 161220951) has the molecular formula C155H169ClFN39O21S4 and a molecular weight of 3097.03 g/mol. Its IUPAC name is 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide.

Molecular Properties

• Compound Name: 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide
• PubChem CID: 161220951
• Molecular Formula: C155H169ClFN39O21S4
• Molecular Weight: 3097.03 g/mol
• Exact Mass: 3094.19
• IUPAC Name: 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide
• SMILES: C=CC(=O)N(C)CC#CCN1C(=O)Cc2cc(Nc3ncc(C)c(NCc4cccnc4N(C)S(C)(=O)=O)n3)ccc21.C=CC(=O)N(C)Cc1cccc(C2=Cc3cc(Nc4ncc(C)c(NCc5cccnc5N(C)S(C)(=O)=O)n4)ccc3C2)c1.C=CC(=O)N1CCC(NC(=O)c2ccc(Nc3ncc(C)c(NCc4cccnc4N(C)S(C)(=O)=O)n3)c(OC)c2)CC1.C=CC(=O)NCc1cccc(N2C(=O)Cc3cc(Nc4ncc(C)c(NCc5cccnc5N(C)S(C)(=O)=O)n4)ccc32)c1.CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCOC(C4CN(C(=O)c5cccnc5F)CCO4)C3)cc2OC)ncc1Cl
• InChI: InChI=1S/C33H34ClFN8O5.C33H35N7O3S.C31H32N8O4S.C29H36N8O5S.C29H32N8O4S/c1-36-31(44)21-6-3-4-8-24(21)39-30-23(34)17-38-33(41-30)40-25-10-9-20(16-26(25)46-2)42-12-14-47-27(18-42)28-19-43(13-15-48-28)32(45)22-7-5-11-37-29(22)35;1-6-30(41)39(3)21-23-9-7-10-24(15-23)27-16-25-12-13-29(18-28(25)17-27)37-33-36-19-22(2)31(38-33)35-20-26-11-8-14-34-32(26)40(4)44(5,42)43;1-5-27(40)33-18-21-8-6-10-25(14-21)39-26-12-11-24(15-23(26)16-28(39)41)36-31-35-17-20(2)29(37-31)34-19-22-9-7-13-32-30(22)38(3)44(4,42)43;1-6-25(38)37-14-11-22(12-15-37)33-28(39)20-9-10-23(24(16-20)42-4)34-29-32-17-19(2)26(35-29)31-18-21-8-7-13-30-27(21)36(3)43(5,40)41;1-6-25(38)35(3)14-7-8-15-37-24-12-11-23(16-22(24)17-26(37)39)33-29-32-18-20(2)27(34-29)31-19-21-10-9-13-30-28(21)36(4)42(5,40)41/h3-11,16-17,27-28H,12-15,18-19H2,1-2H3,(H,36,44)(H2,38,39,40,41);6-15,17-19H,1,16,20-21H2,2-5H3,(H2,35,36,37,38);5-15,17H,1,16,18-19H2,2-4H3,(H,33,40)(H2,34,35,36,37);6-10,13,16-17,22H,1,11-12,14-15,18H2,2-5H3,(H,33,39)(H2,31,32,34,35);6,9-13,16,18H,1,14-15,17,19H2,2-5H3,(H2,31,32,33,34)
• InChIKey: UXMPMTWUUSLGEX-UHFFFAOYSA-N
• XLogP: 18.71
• TPSA: 712.49 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 47
• Rotatable Bonds: 52
• Heavy Atoms: 221
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3097.03
LogP ≤ 5	18.71
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	47

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide?

The IUPAC name of 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide (CID 161220951) is 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide.

What is the SMILES notation for 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide?

The canonical SMILES for 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide is C=CC(=O)N(C)CC#CCN1C(=O)Cc2cc(Nc3ncc(C)c(NCc4cccnc4N(C)S(C)(=O)=O)n3)ccc21.C=CC(=O)N(C)Cc1cccc(C2=Cc3cc(Nc4ncc(C)c(NCc5cccnc5N(C)S(C)(=O)=O)n4)ccc3C2)c1.C=CC(=O)N1CCC(NC(=O)c2ccc(Nc3ncc(C)c(NCc4cccnc4N(C)S(C)(=O)=O)n3)c(OC)c2)CC1.C=CC(=O)NCc1cccc(N2C(=O)Cc3cc(Nc4ncc(C)c(NCc5cccnc5N(C)S(C)(=O)=O)n4)ccc32)c1.CNC(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCOC(C4CN(C(=O)c5cccnc5F)CCO4)C3)cc2OC)ncc1Cl.

What is the InChIKey of 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide?

The InChIKey is UXMPMTWUUSLGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H34ClFN8O5.C33H35N7O3S.C31H32N8O4S.C29H36N8O5S.C29H32N8O4S/c1-36-31(44)21-6-3-4-8-24(21)39-30-23(34)17-38-33(41-30)40-25-10-9-20(16-26(25)46-2)42-12-14-47-27(18-42)28-19-43(13-15-48-28)32(45)22-7-5-11-37-29(22)35;1-6-30(41)39(3)21-23-9-7-10-24(15-23)27-16-25-12-13-29(18-28(25)17-27)37-33-36-19-22(2)31(38-33)35-20-26-11-8-14-34-32(26)40(4)44(5,42)43;1-5-27(40)33-18-21-8-6-10-25(14-21)39-26-12-11-24(15-23(26)16-28(39)41)36-31-35-17-20(2)29(37-31)34-19-22-9-7-13-32-30(22)38(3)44(4,42)43;1-6-25(38)37-14-11-22(12-15-37)33-28(39)20-9-10-23(24(16-20)42-4)34-29-32-17-19(2)26(35-29)31-18-21-8-7-13-30-27(21)36(3)43(5,40)41;1-6-25(38)35(3)14-7-8-15-37-24-12-11-23(16-22(24)17-26(37)39)33-29-32-18-20(2)27(34-29)31-19-21-10-9-13-30-28(21)36(4)42(5,40)41/h3-11,16-17,27-28H,12-15,18-19H2,1-2H3,(H,36,44)(H2,38,39,40,41);6-15,17-19H,1,16,20-21H2,2-5H3,(H2,35,36,37,38);5-15,17H,1,16,18-19H2,2-4H3,(H,33,40)(H2,34,35,36,37);6-10,13,16-17,22H,1,11-12,14-15,18H2,2-5H3,(H,33,39)(H2,31,32,34,35);6,9-13,16,18H,1,14-15,17,19H2,2-5H3,(H2,31,32,33,34).

What are the key properties of 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide?

2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide has a molecular weight of 3097.03 g/mol, XLogP of 18.71, 52 rotatable bonds, 13 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[5-chloro-2-[4-[2-[4-(2-fluoropyridine-3-carbonyl)morpholin-2-yl]morpholin-4-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-N-methylbenzamide;3-methoxy-4-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-N-(1-prop-2-enoylpiperidin-4-yl)benzamide;N-methyl-N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-1H-inden-2-yl]phenyl]methyl]prop-2-enamide;N-methyl-N-[4-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]but-2-ynyl]prop-2-enamide;N-[[3-[5-[[5-methyl-4-[[2-[methyl(methylsulfonyl)amino]-3-pyridinyl]methylamino]pyrimidin-2-yl]amino]-2-oxo-3H-indol-1-yl]phenyl]methyl]prop-2-enamide is sourced from PubChem (CID 161220951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).