4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine

C97H66Cl2F24N28O2 — CID 158811259

About 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine

4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine (PubChem CID 158811259) has the molecular formula C97H66Cl2F24N28O2 and a molecular weight of 2182.65 g/mol. Its IUPAC name is 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine.

Molecular Properties

• Compound Name: 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine
• PubChem CID: 158811259
• Molecular Formula: C97H66Cl2F24N28O2
• Molecular Weight: 2182.65 g/mol
• Exact Mass: 2180.49
• IUPAC Name: 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine
• SMILES: Cc1nc2cc(F)c(F)cc2n1-c1cc(Cl)nc(Nc2ccc(C(F)(F)F)c(F)c2)n1.Cc1nc2cc(F)c(F)cc2n1-c1cc(Cl)nc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2cc(F)c(F)cc2n1-c1cc(N)nc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2cc(F)c(F)cc2n1-c1cc(NCCO)nc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2ccccc2n1-c1cc(NO)nc(Nc2ccc(C(F)(F)F)cc2)n1
• InChI: InChI=1S/C21H17F5N6O.C19H10ClF6N5.C19H11ClF5N5.C19H13F5N6.C19H15F3N6O/c1-11-28-16-8-14(22)15(23)9-17(16)32(11)19-10-18(27-6-7-33)30-20(31-19)29-13-4-2-12(3-5-13)21(24,25)26;1-8-27-14-5-12(22)13(23)6-15(14)31(8)17-7-16(20)29-18(30-17)28-9-2-3-10(11(21)4-9)19(24,25)26;1-9-26-14-6-12(21)13(22)7-15(14)30(9)17-8-16(20)28-18(29-17)27-11-4-2-10(3-5-11)19(23,24)25;1-9-26-14-6-12(20)13(21)7-15(14)30(9)17-8-16(25)28-18(29-17)27-11-4-2-10(3-5-11)19(22,23)24;1-11-23-14-4-2-3-5-15(14)28(11)17-10-16(27-29)25-18(26-17)24-13-8-6-12(7-9-13)19(20,21)22/h2-5,8-10,33H,6-7H2,1H3,(H2,27,29,30,31);2-7H,1H3,(H,28,29,30);2-8H,1H3,(H,27,28,29);2-8H,1H3,(H3,25,27,28,29);2-10,29H,1H3,(H2,24,25,26,27)
• InChIKey: IUSINLUJQXOOIW-UHFFFAOYSA-N
• XLogP: 25.78
• TPSA: 368.69 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 30
• Rotatable Bonds: 19
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2182.65
LogP ≤ 5	25.78
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine?

The IUPAC name of 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine (CID 158811259) is 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine.

What is the SMILES notation for 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine?

The canonical SMILES for 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine is Cc1nc2cc(F)c(F)cc2n1-c1cc(Cl)nc(Nc2ccc(C(F)(F)F)c(F)c2)n1.Cc1nc2cc(F)c(F)cc2n1-c1cc(Cl)nc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2cc(F)c(F)cc2n1-c1cc(N)nc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2cc(F)c(F)cc2n1-c1cc(NCCO)nc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2ccccc2n1-c1cc(NO)nc(Nc2ccc(C(F)(F)F)cc2)n1.

What is the InChIKey of 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine?

The InChIKey is IUSINLUJQXOOIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F5N6O.C19H10ClF6N5.C19H11ClF5N5.C19H13F5N6.C19H15F3N6O/c1-11-28-16-8-14(22)15(23)9-17(16)32(11)19-10-18(27-6-7-33)30-20(31-19)29-13-4-2-12(3-5-13)21(24,25)26;1-8-27-14-5-12(22)13(23)6-15(14)31(8)17-7-16(20)29-18(30-17)28-9-2-3-10(11(21)4-9)19(24,25)26;1-9-26-14-6-12(21)13(22)7-15(14)30(9)17-8-16(20)28-18(29-17)27-11-4-2-10(3-5-11)19(23,24)25;1-9-26-14-6-12(20)13(21)7-15(14)30(9)17-8-16(25)28-18(29-17)27-11-4-2-10(3-5-11)19(22,23)24;1-11-23-14-4-2-3-5-15(14)28(11)17-10-16(27-29)25-18(26-17)24-13-8-6-12(7-9-13)19(20,21)22/h2-5,8-10,33H,6-7H2,1H3,(H2,27,29,30,31);2-7H,1H3,(H,28,29,30);2-8H,1H3,(H,27,28,29);2-8H,1H3,(H3,25,27,28,29);2-10,29H,1H3,(H2,24,25,26,27).

What are the key properties of 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine?

4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine has a molecular weight of 2182.65 g/mol, XLogP of 25.78, 19 rotatable bonds, 10 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrimidin-2-amine;4-chloro-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;2-[[6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]ethanol;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;N-[6-(2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]hydroxylamine is sourced from PubChem (CID 158811259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).