5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide

C120H120Cl2F7N25O13 — CID 159157109

About 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide

5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide (PubChem CID 159157109) has the molecular formula C120H120Cl2F7N25O13 and a molecular weight of 2324.33 g/mol. Its IUPAC name is 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide.

Molecular Properties

• Compound Name: 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide
• PubChem CID: 159157109
• Molecular Formula: C120H120Cl2F7N25O13
• Molecular Weight: 2324.33 g/mol
• Exact Mass: 2321.88
• IUPAC Name: 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide
• SMILES: CC(C)Cc1cc(Nc2cc(Cl)cc(-c3cccc(O)c3)c2)ccc1C(=O)NNc1ncc(F)c(N2CCOCC2)n1.CC(C)c1cc(Nc2cc(O)cc(-c3cccc(O)c3)c2)ccc1C(=O)NNc1ncc(F)c(N2CCOCC2)n1.CC(C)c1nc(C(=O)NNc2ncc(F)c(N3CCOCC3)n2)ccc1Nc1cc(-c2cccc(O)c2)cc(C(F)(F)F)c1.CCc1cc(Nc2cccc(-c3cccc(O)c3)c2)c(Cl)cc1C(=O)NNc1ncc(F)c(N2CCOCC2)n1
• InChI: InChI=1S/C31H32ClFN6O3.C30H29F4N7O3.C30H31FN6O4.C29H28ClFN6O3/c1-19(2)12-22-15-24(35-25-14-21(13-23(32)17-25)20-4-3-5-26(40)16-20)6-7-27(22)30(41)37-38-31-34-18-28(33)29(36-31)39-8-10-42-11-9-39;1-17(2)26-24(36-21-13-19(12-20(15-21)30(32,33)34)18-4-3-5-22(42)14-18)6-7-25(37-26)28(43)39-40-29-35-16-23(31)27(38-29)41-8-10-44-11-9-41;1-18(2)26-16-21(33-22-12-20(14-24(39)15-22)19-4-3-5-23(38)13-19)6-7-25(26)29(40)35-36-30-32-17-27(31)28(34-30)37-8-10-41-11-9-37;1-2-18-15-26(33-21-7-3-5-19(13-21)20-6-4-8-22(38)14-20)24(30)16-23(18)28(39)35-36-29-32-17-25(31)27(34-29)37-9-11-40-12-10-37/h3-7,13-19,35,40H,8-12H2,1-2H3,(H,37,41)(H,34,36,38);3-7,12-17,36,42H,8-11H2,1-2H3,(H,39,43)(H,35,38,40);3-7,12-18,33,38-39H,8-11H2,1-2H3,(H,35,40)(H,32,34,36);3-8,13-17,33,38H,2,9-12H2,1H3,(H,35,39)(H,32,34,36)
• InChIKey: KKAKGMLVSQGOOI-UHFFFAOYSA-N
• XLogP: 22.74
• TPSA: 479.68 Ų
• H-Bond Donors: 17
• H-Bond Acceptors: 34
• Rotatable Bonds: 33
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2324.33
LogP ≤ 5	22.74
H-Bond Donors ≤ 5	17
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide?

The IUPAC name of 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide (CID 159157109) is 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide.

What is the SMILES notation for 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide?

The canonical SMILES for 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide is CC(C)Cc1cc(Nc2cc(Cl)cc(-c3cccc(O)c3)c2)ccc1C(=O)NNc1ncc(F)c(N2CCOCC2)n1.CC(C)c1cc(Nc2cc(O)cc(-c3cccc(O)c3)c2)ccc1C(=O)NNc1ncc(F)c(N2CCOCC2)n1.CC(C)c1nc(C(=O)NNc2ncc(F)c(N3CCOCC3)n2)ccc1Nc1cc(-c2cccc(O)c2)cc(C(F)(F)F)c1.CCc1cc(Nc2cccc(-c3cccc(O)c3)c2)c(Cl)cc1C(=O)NNc1ncc(F)c(N2CCOCC2)n1.

What is the InChIKey of 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide?

The InChIKey is KKAKGMLVSQGOOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32ClFN6O3.C30H29F4N7O3.C30H31FN6O4.C29H28ClFN6O3/c1-19(2)12-22-15-24(35-25-14-21(13-23(32)17-25)20-4-3-5-26(40)16-20)6-7-27(22)30(41)37-38-31-34-18-28(33)29(36-31)39-8-10-42-11-9-39;1-17(2)26-24(36-21-13-19(12-20(15-21)30(32,33)34)18-4-3-5-22(42)14-18)6-7-25(37-26)28(43)39-40-29-35-16-23(31)27(38-29)41-8-10-44-11-9-41;1-18(2)26-16-21(33-22-12-20(14-24(39)15-22)19-4-3-5-23(38)13-19)6-7-25(26)29(40)35-36-30-32-17-27(31)28(34-30)37-8-10-41-11-9-37;1-2-18-15-26(33-21-7-3-5-19(13-21)20-6-4-8-22(38)14-20)24(30)16-23(18)28(39)35-36-29-32-17-25(31)27(34-29)37-9-11-40-12-10-37/h3-7,13-19,35,40H,8-12H2,1-2H3,(H,37,41)(H,34,36,38);3-7,12-17,36,42H,8-11H2,1-2H3,(H,39,43)(H,35,38,40);3-7,12-18,33,38-39H,8-11H2,1-2H3,(H,35,40)(H,32,34,36);3-8,13-17,33,38H,2,9-12H2,1H3,(H,35,39)(H,32,34,36).

What are the key properties of 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide?

5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide has a molecular weight of 2324.33 g/mol, XLogP of 22.74, 33 rotatable bonds, 17 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-2-ethyl-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-(3-hydroxyphenyl)anilino]benzohydrazide;4-[3-chloro-5-(3-hydroxyphenyl)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-2-(2-methylpropyl)benzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[3-hydroxy-5-(3-hydroxyphenyl)anilino]-2-propan-2-ylbenzohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyphenyl)-5-(trifluoromethyl)anilino]-6-propan-2-ylpyridine-2-carbohydrazide is sourced from PubChem (CID 159157109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).