5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide

C135H126Cl3F8N37O15 — CID 159612690

About 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide

5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide (PubChem CID 159612690) has the molecular formula C135H126Cl3F8N37O15 and a molecular weight of 2765.08 g/mol. Its IUPAC name is 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide.

Molecular Properties

• Compound Name: 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide
• PubChem CID: 159612690
• Molecular Formula: C135H126Cl3F8N37O15
• Molecular Weight: 2765.08 g/mol
• Exact Mass: 2761.92
• IUPAC Name: 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide
• SMILES: Cc1cc(Cl)cc(Oc2cccc(Nc3ccc(C(=O)NNc4ncc(F)c(N5CCOCC5)n4)nc3)c2)c1.Cc1cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)cc(Cl)c1Cc1cccc(O)c1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(Nc3cccc(O)c3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Nc3cccc(O)c3)cc(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cccc(Cc3cccc(O)c3)c2)cn1
• InChI: InChI=1S/C28H27ClFN7O3.C27H25ClFN7O3.C27H24F4N8O3.C27H26FN7O3.C26H24ClFN8O3/c1-17-11-20(14-23(29)22(17)13-18-3-2-4-21(38)12-18)33-19-5-6-25(31-15-19)27(39)35-36-28-32-16-24(30)26(34-28)37-7-9-40-10-8-37;1-17-11-18(28)13-22(12-17)39-21-4-2-3-19(14-21)32-20-5-6-24(30-15-20)26(37)34-35-27-31-16-23(29)25(33-27)36-7-9-38-10-8-36;28-22-15-33-26(36-24(22)39-6-8-42-9-7-39)38-37-25(41)23-5-4-18(14-32-23)35-20-11-16(27(29,30)31)10-19(12-20)34-17-2-1-3-21(40)13-17;28-23-17-30-27(32-25(23)35-9-11-38-12-10-35)34-33-26(37)24-8-7-21(16-29-24)31-20-5-1-3-18(14-20)13-19-4-2-6-22(36)15-19;27-16-10-19(31-17-2-1-3-21(37)13-17)12-20(11-16)32-18-4-5-23(29-14-18)25(38)34-35-26-30-15-22(28)24(33-26)36-6-8-39-9-7-36/h2-6,11-12,14-16,33,38H,7-10,13H2,1H3,(H,35,39)(H,32,34,36);2-6,11-16,32H,7-10H2,1H3,(H,34,37)(H,31,33,35);1-5,10-15,34-35,40H,6-9H2,(H,37,41)(H,33,36,38);1-8,14-17,31,36H,9-13H2,(H,33,37)(H,30,32,34);1-5,10-15,31-32,37H,6-9H2,(H,34,38)(H,30,33,35)
• InChIKey: MMWYXVYNLBZEJO-UHFFFAOYSA-N
• XLogP: 22.62
• TPSA: 635.71 Ų
• H-Bond Donors: 21
• H-Bond Acceptors: 47
• Rotatable Bonds: 40
• Heavy Atoms: 198
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2765.08
LogP ≤ 5	22.62
H-Bond Donors ≤ 5	21
H-Bond Acceptors ≤ 10	47

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide?

The IUPAC name of 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide (CID 159612690) is 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide.

What is the SMILES notation for 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide?

The canonical SMILES for 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide is Cc1cc(Cl)cc(Oc2cccc(Nc3ccc(C(=O)NNc4ncc(F)c(N5CCOCC5)n4)nc3)c2)c1.Cc1cc(Nc2ccc(C(=O)NNc3ncc(F)c(N4CCOCC4)n3)nc2)cc(Cl)c1Cc1cccc(O)c1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Cl)cc(Nc3cccc(O)c3)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cc(Nc3cccc(O)c3)cc(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2cccc(Cc3cccc(O)c3)c2)cn1.

What is the InChIKey of 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide?

The InChIKey is MMWYXVYNLBZEJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H27ClFN7O3.C27H25ClFN7O3.C27H24F4N8O3.C27H26FN7O3.C26H24ClFN8O3/c1-17-11-20(14-23(29)22(17)13-18-3-2-4-21(38)12-18)33-19-5-6-25(31-15-19)27(39)35-36-28-32-16-24(30)26(34-28)37-7-9-40-10-8-37;1-17-11-18(28)13-22(12-17)39-21-4-2-3-19(14-21)32-20-5-6-24(30-15-20)26(37)34-35-27-31-16-23(29)25(33-27)36-7-9-38-10-8-36;28-22-15-33-26(36-24(22)39-6-8-42-9-7-39)38-37-25(41)23-5-4-18(14-32-23)35-20-11-16(27(29,30)31)10-19(12-20)34-17-2-1-3-21(40)13-17;28-23-17-30-27(32-25(23)35-9-11-38-12-10-35)34-33-26(37)24-8-7-21(16-29-24)31-20-5-1-3-18(14-20)13-19-4-2-6-22(36)15-19;27-16-10-19(31-17-2-1-3-21(37)13-17)12-20(11-16)32-18-4-5-23(29-14-18)25(38)34-35-26-30-15-22(28)24(33-26)36-6-8-39-9-7-36/h2-6,11-12,14-16,33,38H,7-10,13H2,1H3,(H,35,39)(H,32,34,36);2-6,11-16,32H,7-10H2,1H3,(H,34,37)(H,31,33,35);1-5,10-15,34-35,40H,6-9H2,(H,37,41)(H,33,36,38);1-8,14-17,31,36H,9-13H2,(H,33,37)(H,30,32,34);1-5,10-15,31-32,37H,6-9H2,(H,34,38)(H,30,33,35).

What are the key properties of 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide?

5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide has a molecular weight of 2765.08 g/mol, XLogP of 22.62, 40 rotatable bonds, 21 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[3-chloro-5-(3-hydroxyanilino)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-chloro-4-[(3-hydroxyphenyl)methyl]-5-methylanilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-[3-(3-chloro-5-methylphenoxy)anilino]-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-(3-hydroxyanilino)-5-(trifluoromethyl)anilino]pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[3-[(3-hydroxyphenyl)methyl]anilino]pyridine-2-carbohydrazide is sourced from PubChem (CID 159612690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).