N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide

C140H124Cl6F12N28O14 — CID 162092192

IUPACN-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide
SMILESCC(C)c1nc2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3ccn[nH]3)c2n1C(C)C.C[C@@H]1CCCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4cc(=O)cc[nH]4)c3n21.C[C@@H]1CCCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(N4CCCC4)c3n21.C[C@@H]1CCCn2c1nc1cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3ccn[nH]3)c12.C[C@@H]1COc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4cccnn4)c3n21.O=C(Nc1ccc(OC(F)(F)Cl)cc1)c1cc(-c2ccn[nH]2)c2c(c1)nc1n2CCCC1
InChIInChI=1S/C25H21ClF2N4O3.C24H24ClF2N5O2.C24H25ClF2N4O2.C23H20ClF2N5O2.C22H16ClF2N5O3.C22H18ClF2N5O2/c1-14-3-2-4-22-31-21-12-15(11-19(23(21)32(14)22)20-13-17(33)9-10-29-20)24(34)30-16-5-7-18(8-6-16)35-25(26,27)28;1-13(2)22-30-20-12-15(11-18(19-9-10-28-31-19)21(20)32(22)14(3)4)23(33)29-16-5-7-17(8-6-16)34-24(25,26)27;1-15-5-4-6-21-29-19-13-16(14-20(22(19)31(15)21)30-11-2-3-12-30)23(32)28-17-7-9-18(10-8-17)33-24(25,26)27;1-13-3-2-10-31-20-17(18-8-9-27-30-18)11-14(12-19(20)29-21(13)31)22(32)28-15-4-6-16(7-5-15)33-23(24,25)26;1-12-11-32-21-28-18-10-13(9-16(19(18)30(12)21)17-3-2-8-26-29-17)20(31)27-14-4-6-15(7-5-14)33-22(23,24)25;23-22(24,25)32-15-6-4-14(5-7-15)27-21(31)13-11-16(17-8-9-26-29-17)20-18(12-13)28-19-3-1-2-10-30(19)20/h5-14H,2-4H2,1H3,(H,29,33)(H,30,34);5-14H,1-4H3,(H,28,31)(H,29,33);7-10,13-15H,2-6,11-12H2,1H3,(H,28,32);4-9,11-13H,2-3,10H2,1H3,(H,27,30)(H,28,32);2-10,12H,11H2,1H3,(H,27,31);4-9,11-12H,1-3,10H2,(H,26,29)(H,27,31)/t14-;;15-;13-;12-;/m1.111./s1
InChIKeyZDTOGSHNRWOUMT-VRECPBRCSA-N
MW2863.41 g/mol
LogP34.01
Rot. Bonds32

About N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide

N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide (PubChem CID 162092192) has the molecular formula C140H124Cl6F12N28O14 and a molecular weight of 2863.41 g/mol. Its IUPAC name is N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide.

Molecular Properties

Compound NameN-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide
PubChem CID162092192
Molecular FormulaC140H124Cl6F12N28O14
Molecular Weight2863.41 g/mol
Exact Mass2858.78
IUPAC NameN-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide
SMILESCC(C)c1nc2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3ccn[nH]3)c2n1C(C)C.C[C@@H]1CCCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4cc(=O)cc[nH]4)c3n21.C[C@@H]1CCCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(N4CCCC4)c3n21.C[C@@H]1CCCn2c1nc1cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3ccn[nH]3)c12.C[C@@H]1COc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4cccnn4)c3n21.O=C(Nc1ccc(OC(F)(F)Cl)cc1)c1cc(-c2ccn[nH]2)c2c(c1)nc1n2CCCC1
InChIInChI=1S/C25H21ClF2N4O3.C24H24ClF2N5O2.C24H25ClF2N4O2.C23H20ClF2N5O2.C22H16ClF2N5O3.C22H18ClF2N5O2/c1-14-3-2-4-22-31-21-12-15(11-19(23(21)32(14)22)20-13-17(33)9-10-29-20)24(34)30-16-5-7-18(8-6-16)35-25(26,27)28;1-13(2)22-30-20-12-15(11-18(19-9-10-28-31-19)21(20)32(22)14(3)4)23(33)29-16-5-7-17(8-6-16)34-24(25,26)27;1-15-5-4-6-21-29-19-13-16(14-20(22(19)31(15)21)30-11-2-3-12-30)23(32)28-17-7-9-18(10-8-17)33-24(25,26)27;1-13-3-2-10-31-20-17(18-8-9-27-30-18)11-14(12-19(20)29-21(13)31)22(32)28-15-4-6-16(7-5-15)33-23(24,25)26;1-12-11-32-21-28-18-10-13(9-16(19(18)30(12)21)17-3-2-8-26-29-17)20(31)27-14-4-6-15(7-5-14)33-22(23,24)25;23-22(24,25)32-15-6-4-14(5-7-15)27-21(31)13-11-16(17-8-9-26-29-17)20-18(12-13)28-19-3-1-2-10-30(19)20/h5-14H,2-4H2,1H3,(H,29,33)(H,30,34);5-14H,1-4H3,(H,28,31)(H,29,33);7-10,13-15H,2-6,11-12H2,1H3,(H,28,32);4-9,11-13H,2-3,10H2,1H3,(H,27,30)(H,28,32);2-10,12H,11H2,1H3,(H,27,31);4-9,11-12H,1-3,10H2,(H,26,29)(H,27,31)/t14-;;15-;13-;12-;/m1.111./s1
InChIKeyZDTOGSHNRWOUMT-VRECPBRCSA-N
XLogP34.01
TPSA494.05 Ų
H-Bond Donors10
H-Bond Acceptors32
Rotatable Bonds32
Heavy Atoms200
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002863.41
LogP ≤ 534.01
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide?
The IUPAC name of N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide (CID 162092192) is N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide.
What is the SMILES notation for N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide?
The canonical SMILES for N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide is CC(C)c1nc2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3ccn[nH]3)c2n1C(C)C.C[C@@H]1CCCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4cc(=O)cc[nH]4)c3n21.C[C@@H]1CCCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(N4CCCC4)c3n21.C[C@@H]1CCCn2c1nc1cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3ccn[nH]3)c12.C[C@@H]1COc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4cccnn4)c3n21.O=C(Nc1ccc(OC(F)(F)Cl)cc1)c1cc(-c2ccn[nH]2)c2c(c1)nc1n2CCCC1.
What is the InChIKey of N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide?
The InChIKey is ZDTOGSHNRWOUMT-VRECPBRCSA-N. The full InChI is InChI=1S/C25H21ClF2N4O3.C24H24ClF2N5O2.C24H25ClF2N4O2.C23H20ClF2N5O2.C22H16ClF2N5O3.C22H18ClF2N5O2/c1-14-3-2-4-22-31-21-12-15(11-19(23(21)32(14)22)20-13-17(33)9-10-29-20)24(34)30-16-5-7-18(8-6-16)35-25(26,27)28;1-13(2)22-30-20-12-15(11-18(19-9-10-28-31-19)21(20)32(22)14(3)4)23(33)29-16-5-7-17(8-6-16)34-24(25,26)27;1-15-5-4-6-21-29-19-13-16(14-20(22(19)31(15)21)30-11-2-3-12-30)23(32)28-17-7-9-18(10-8-17)33-24(25,26)27;1-13-3-2-10-31-20-17(18-8-9-27-30-18)11-14(12-19(20)29-21(13)31)22(32)28-15-4-6-16(7-5-15)33-23(24,25)26;1-12-11-32-21-28-18-10-13(9-16(19(18)30(12)21)17-3-2-8-26-29-17)20(31)27-14-4-6-15(7-5-14)33-22(23,24)25;23-22(24,25)32-15-6-4-14(5-7-15)27-21(31)13-11-16(17-8-9-26-29-17)20-18(12-13)28-19-3-1-2-10-30(19)20/h5-14H,2-4H2,1H3,(H,29,33)(H,30,34);5-14H,1-4H3,(H,28,31)(H,29,33);7-10,13-15H,2-6,11-12H2,1H3,(H,28,32);4-9,11-13H,2-3,10H2,1H3,(H,27,30)(H,28,32);2-10,12H,11H2,1H3,(H,27,31);4-9,11-12H,1-3,10H2,(H,26,29)(H,27,31)/t14-;;15-;13-;12-;/m1.111./s1.
What are the key properties of N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide?
N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide has a molecular weight of 2863.41 g/mol, XLogP of 34.01, 32 rotatable bonds, 10 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[chloro(difluoro)methoxy]phenyl]-1,2-di(propan-2-yl)-7-(1H-pyrazol-5-yl)benzimidazole-5-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-(4-oxo-1H-pyridin-2-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-8-pyridazin-3-yl-1,2-dihydro-[1,3]oxazolo[3,2-a]benzimidazole-6-carboxamide;(1R)-N-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-9-pyrrolidin-1-yl-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-9-(1H-pyrazol-5-yl)-1,2,3,4-tetrahydropyrido[1,2-a]benzimidazole-7-carboxamide is sourced from PubChem (CID 162092192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).