6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine

C178H217F3N48O6S4 — CID 165009949

About 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine

6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine (PubChem CID 165009949) has the molecular formula C178H217F3N48O6S4 and a molecular weight of 3310.29 g/mol. Its IUPAC name is 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine.

Molecular Properties

• Compound Name: 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine
• PubChem CID: 165009949
• Molecular Formula: C178H217F3N48O6S4
• Molecular Weight: 3310.29 g/mol
• Exact Mass: 3307.70
• IUPAC Name: 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine
• SMILES: CC(C)Cc1cccc(-n2c(C3CC3)c(F)c3cnc(Nc4ccc(N5CCN(C)CC5)cc4)nc32)n1.CC(C)Cc1cccc(-n2c(C3CC3)cc3cnc(Nc4ccc(N5CCN(C)CC5)cc4)nc32)n1.CN1CCC(N2CCN(c3ccc(Nc4ncc5c(F)c(C6CC6)n(-c6cccc(N=S(C)(C)=O)n6)c5n4)cc3)CC2)CC1.CN1CCN(C2CCN(c3ccc(Nc4ncc5cc(C6CC6)n(-c6cccc(N=S(C)(C)=O)n6)c5n4)cc3)CC2)CC1.CS(C)(=O)=Nc1cccc(-n2c(C3CC3)c(F)c3cnc(Nc4ccc(N5CCN(CCO)CC5)cc4)nc32)n1.CS(C)(=O)=Nc1cccc(-n2c(C3CC3)cc3cnc(Nc4ccc(N5CCN(CCO)CC5)cc4)nc32)n1
• InChI: InChI=1S/C32H40FN9OS.C32H41N9OS.C29H34FN7.C29H35N7.C28H33FN8O2S.C28H34N8O2S/c1-39-15-13-25(14-16-39)41-19-17-40(18-20-41)24-11-9-23(10-12-24)35-32-34-21-26-29(33)30(22-7-8-22)42(31(26)37-32)28-6-4-5-27(36-28)38-44(2,3)43;1-38-17-19-40(20-18-38)27-13-15-39(16-14-27)26-11-9-25(10-12-26)34-32-33-22-24-21-28(23-7-8-23)41(31(24)36-32)30-6-4-5-29(35-30)37-43(2,3)42;1-19(2)17-22-5-4-6-25(32-22)37-27(20-7-8-20)26(30)24-18-31-29(34-28(24)37)33-21-9-11-23(12-10-21)36-15-13-35(3)14-16-36;1-20(2)17-24-5-4-6-27(31-24)36-26(21-7-8-21)18-22-19-30-29(33-28(22)36)32-23-9-11-25(12-10-23)35-15-13-34(3)14-16-35;1-40(2,39)34-23-4-3-5-24(32-23)37-26(19-6-7-19)25(29)22-18-30-28(33-27(22)37)31-20-8-10-21(11-9-20)36-14-12-35(13-15-36)16-17-38;1-39(2,38)33-25-4-3-5-26(31-25)36-24(20-6-7-20)18-21-19-29-28(32-27(21)36)30-22-8-10-23(11-9-22)35-14-12-34(13-15-35)16-17-37/h4-6,9-12,21-22,25H,7-8,13-20H2,1-3H3,(H,34,35,37);4-6,9-12,21-23,27H,7-8,13-20H2,1-3H3,(H,33,34,36);4-6,9-12,18-20H,7-8,13-17H2,1-3H3,(H,31,33,34);4-6,9-12,18-21H,7-8,13-17H2,1-3H3,(H,30,32,33);3-5,8-11,18-19,38H,6-7,12-17H2,1-2H3,(H,30,31,33);3-5,8-11,18-20,37H,6-7,12-17H2,1-2H3,(H,29,30,32)
• InChIKey: JNWNCKFFVMRYFU-UHFFFAOYSA-N
• XLogP: 29.03
• TPSA: 537.32 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 54
• Rotatable Bonds: 44
• Heavy Atoms: 239
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3310.29
LogP ≤ 5	29.03
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	54

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine?

The IUPAC name of 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine (CID 165009949) is 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine.

What is the SMILES notation for 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine?

The canonical SMILES for 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine is CC(C)Cc1cccc(-n2c(C3CC3)c(F)c3cnc(Nc4ccc(N5CCN(C)CC5)cc4)nc32)n1.CC(C)Cc1cccc(-n2c(C3CC3)cc3cnc(Nc4ccc(N5CCN(C)CC5)cc4)nc32)n1.CN1CCC(N2CCN(c3ccc(Nc4ncc5c(F)c(C6CC6)n(-c6cccc(N=S(C)(C)=O)n6)c5n4)cc3)CC2)CC1.CN1CCN(C2CCN(c3ccc(Nc4ncc5cc(C6CC6)n(-c6cccc(N=S(C)(C)=O)n6)c5n4)cc3)CC2)CC1.CS(C)(=O)=Nc1cccc(-n2c(C3CC3)c(F)c3cnc(Nc4ccc(N5CCN(CCO)CC5)cc4)nc32)n1.CS(C)(=O)=Nc1cccc(-n2c(C3CC3)cc3cnc(Nc4ccc(N5CCN(CCO)CC5)cc4)nc32)n1.

What is the InChIKey of 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine?

The InChIKey is JNWNCKFFVMRYFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H40FN9OS.C32H41N9OS.C29H34FN7.C29H35N7.C28H33FN8O2S.C28H34N8O2S/c1-39-15-13-25(14-16-39)41-19-17-40(18-20-41)24-11-9-23(10-12-24)35-32-34-21-26-29(33)30(22-7-8-22)42(31(26)37-32)28-6-4-5-27(36-28)38-44(2,3)43;1-38-17-19-40(20-18-38)27-13-15-39(16-14-27)26-11-9-25(10-12-26)34-32-33-22-24-21-28(23-7-8-23)41(31(24)36-32)30-6-4-5-29(35-30)37-43(2,3)42;1-19(2)17-22-5-4-6-25(32-22)37-27(20-7-8-20)26(30)24-18-31-29(34-28(24)37)33-21-9-11-23(12-10-21)36-15-13-35(3)14-16-36;1-20(2)17-24-5-4-6-27(31-24)36-26(21-7-8-21)18-22-19-30-29(33-28(22)36)32-23-9-11-25(12-10-23)35-15-13-34(3)14-16-35;1-40(2,39)34-23-4-3-5-24(32-23)37-26(19-6-7-19)25(29)22-18-30-28(33-27(22)37)31-20-8-10-21(11-9-20)36-14-12-35(13-15-36)16-17-38;1-39(2,38)33-25-4-3-5-26(31-25)36-24(20-6-7-20)18-21-19-29-28(32-27(21)36)30-22-8-10-23(11-9-22)35-14-12-34(13-15-35)16-17-37/h4-6,9-12,21-22,25H,7-8,13-20H2,1-3H3,(H,34,35,37);4-6,9-12,21-23,27H,7-8,13-20H2,1-3H3,(H,33,34,36);4-6,9-12,18-20H,7-8,13-17H2,1-3H3,(H,31,33,34);4-6,9-12,18-21H,7-8,13-17H2,1-3H3,(H,30,32,33);3-5,8-11,18-19,38H,6-7,12-17H2,1-2H3,(H,30,31,33);3-5,8-11,18-20,37H,6-7,12-17H2,1-2H3,(H,29,30,32).

What are the key properties of 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine?

6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine has a molecular weight of 3310.29 g/mol, XLogP of 29.03, 44 rotatable bonds, 8 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for 6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoro-N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-5-fluoropyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]-N-[4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrrolo[2,3-d]pyrimidin-2-amine;2-[4-[4-[[6-cyclopropyl-7-[6-[[dimethyl(oxo)-λ6-sulfanylidene]amino]-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]phenyl]piperazin-1-yl]ethanol;6-cyclopropyl-5-fluoro-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine;6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-7-[6-(2-methylpropyl)-2-pyridinyl]pyrrolo[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 165009949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).