N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide

C134H107Cl6F14N25O15S4 — CID 158106002

IUPACN-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide
SMILESCC(C)n1c(C(F)F)nc2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3ccsc3)c21.CC(C)n1cnc2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3cccnn3)c21.C[C@@H]1CCSc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4ccn[nH]4)c3n21.C[C@@H]1COCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4ccn[nH]4)c3n21.C[C@@H]1COCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4ccsc4)c3n21.C[C@@H]1COCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4cscn4)c3n21
InChIInChI=1S/C23H18ClF4N3O2S.C23H18ClF2N3O3S.C22H18ClF2N5O3.C22H18ClF2N5O2S.C22H18ClF2N5O2.C22H17ClF2N4O3S/c1-12(2)31-19-17(13-7-8-34-11-13)9-14(10-18(19)30-21(31)20(25)26)22(32)29-15-3-5-16(6-4-15)33-23(24,27)28;1-13-10-31-11-20-28-19-9-15(8-18(21(19)29(13)20)14-6-7-33-12-14)22(30)27-16-2-4-17(5-3-16)32-23(24,25)26;1-12-10-32-11-19-28-18-9-13(8-16(20(18)30(12)19)17-6-7-26-29-17)21(31)27-14-2-4-15(5-3-14)33-22(23,24)25;1-12-7-9-33-21-28-18-11-13(10-16(19(18)30(12)21)17-6-8-26-29-17)20(31)27-14-2-4-15(5-3-14)32-22(23,24)25;1-13(2)30-12-26-19-11-14(10-17(20(19)30)18-4-3-9-27-29-18)21(31)28-15-5-7-16(8-6-15)32-22(23,24)25;1-12-8-31-9-19-28-17-7-13(6-16(20(17)29(12)19)18-10-33-11-26-18)21(30)27-14-2-4-15(5-3-14)32-22(23,24)25/h3-12,20H,1-2H3,(H,29,32);2-9,12-13H,10-11H2,1H3,(H,27,30);2-9,12H,10-11H2,1H3,(H,26,29)(H,27,31);2-6,8,10-12H,7,9H2,1H3,(H,26,29)(H,27,31);3-13H,1-2H3,(H,28,31);2-7,10-12H,8-9H2,1H3,(H,27,30)/t;13-;2*12-;;12-/m.111.1/s1
InChIKeyFPVKCLBGTVMJHL-BDMMMFGDSA-N
MW2914.45 g/mol
LogP35.99
Rot. Bonds33

About N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide

N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide (PubChem CID 158106002) has the molecular formula C134H107Cl6F14N25O15S4 and a molecular weight of 2914.45 g/mol. Its IUPAC name is N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide
PubChem CID158106002
Molecular FormulaC134H107Cl6F14N25O15S4
Molecular Weight2914.45 g/mol
Exact Mass2909.52
IUPAC NameN-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide
SMILESCC(C)n1c(C(F)F)nc2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3ccsc3)c21.CC(C)n1cnc2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3cccnn3)c21.C[C@@H]1CCSc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4ccn[nH]4)c3n21.C[C@@H]1COCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4ccn[nH]4)c3n21.C[C@@H]1COCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4ccsc4)c3n21.C[C@@H]1COCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4cscn4)c3n21
InChIInChI=1S/C23H18ClF4N3O2S.C23H18ClF2N3O3S.C22H18ClF2N5O3.C22H18ClF2N5O2S.C22H18ClF2N5O2.C22H17ClF2N4O3S/c1-12(2)31-19-17(13-7-8-34-11-13)9-14(10-18(19)30-21(31)20(25)26)22(32)29-15-3-5-16(6-4-15)33-23(24,27)28;1-13-10-31-11-20-28-19-9-15(8-18(21(19)29(13)20)14-6-7-33-12-14)22(30)27-16-2-4-17(5-3-16)32-23(24,25)26;1-12-10-32-11-19-28-18-9-13(8-16(20(18)30(12)19)17-6-7-26-29-17)21(31)27-14-2-4-15(5-3-14)33-22(23,24)25;1-12-7-9-33-21-28-18-11-13(10-16(19(18)30(12)21)17-6-8-26-29-17)20(31)27-14-2-4-15(5-3-14)32-22(23,24)25;1-13(2)30-12-26-19-11-14(10-17(20(19)30)18-4-3-9-27-29-18)21(31)28-15-5-7-16(8-6-15)32-22(23,24)25;1-12-8-31-9-19-28-17-7-13(6-16(20(17)29(12)19)18-10-33-11-26-18)21(30)27-14-2-4-15(5-3-14)32-22(23,24)25/h3-12,20H,1-2H3,(H,29,32);2-9,12-13H,10-11H2,1H3,(H,27,30);2-9,12H,10-11H2,1H3,(H,26,29)(H,27,31);2-6,8,10-12H,7,9H2,1H3,(H,26,29)(H,27,31);3-13H,1-2H3,(H,28,31);2-7,10-12H,8-9H2,1H3,(H,27,30)/t;13-;2*12-;;12-/m.111.1/s1
InChIKeyFPVKCLBGTVMJHL-BDMMMFGDSA-N
XLogP35.99
TPSA460.62 Ų
H-Bond Donors8
H-Bond Acceptors36
Rotatable Bonds33
Heavy Atoms198
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002914.45
LogP ≤ 535.99
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

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

Analyze N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide?
The IUPAC name of N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide (CID 158106002) is N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide.
What is the SMILES notation for N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide?
The canonical SMILES for N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide is CC(C)n1c(C(F)F)nc2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3ccsc3)c21.CC(C)n1cnc2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc(-c3cccnn3)c21.C[C@@H]1CCSc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4ccn[nH]4)c3n21.C[C@@H]1COCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4ccn[nH]4)c3n21.C[C@@H]1COCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4ccsc4)c3n21.C[C@@H]1COCc2nc3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(-c4cscn4)c3n21.
What is the InChIKey of N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide?
The InChIKey is FPVKCLBGTVMJHL-BDMMMFGDSA-N. The full InChI is InChI=1S/C23H18ClF4N3O2S.C23H18ClF2N3O3S.C22H18ClF2N5O3.C22H18ClF2N5O2S.C22H18ClF2N5O2.C22H17ClF2N4O3S/c1-12(2)31-19-17(13-7-8-34-11-13)9-14(10-18(19)30-21(31)20(25)26)22(32)29-15-3-5-16(6-4-15)33-23(24,27)28;1-13-10-31-11-20-28-19-9-15(8-18(21(19)29(13)20)14-6-7-33-12-14)22(30)27-16-2-4-17(5-3-16)32-23(24,25)26;1-12-10-32-11-19-28-18-9-13(8-16(20(18)30(12)19)17-6-7-26-29-17)21(31)27-14-2-4-15(5-3-14)33-22(23,24)25;1-12-7-9-33-21-28-18-11-13(10-16(19(18)30(12)21)17-6-8-26-29-17)20(31)27-14-2-4-15(5-3-14)32-22(23,24)25;1-13(2)30-12-26-19-11-14(10-17(20(19)30)18-4-3-9-27-29-18)21(31)28-15-5-7-16(8-6-15)32-22(23,24)25;1-12-8-31-9-19-28-17-7-13(6-16(20(17)29(12)19)18-10-33-11-26-18)21(30)27-14-2-4-15(5-3-14)32-22(23,24)25/h3-12,20H,1-2H3,(H,29,32);2-9,12-13H,10-11H2,1H3,(H,27,30);2-9,12H,10-11H2,1H3,(H,26,29)(H,27,31);2-6,8,10-12H,7,9H2,1H3,(H,26,29)(H,27,31);3-13H,1-2H3,(H,28,31);2-7,10-12H,8-9H2,1H3,(H,27,30)/t;13-;2*12-;;12-/m.111.1/s1.
What are the key properties of N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide?
N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide has a molecular weight of 2914.45 g/mol, XLogP of 35.99, 33 rotatable bonds, 8 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[chloro(difluoro)methoxy]phenyl]-2-(difluoromethyl)-1-propan-2-yl-7-thiophen-3-ylbenzimidazole-5-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1H-pyrazol-5-yl)-3,4-dihydro-2H-[1,3]thiazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;N-[4-[chloro(difluoro)methoxy]phenyl]-1-propan-2-yl-7-pyridazin-3-ylbenzimidazole-5-carboxamide is sourced from PubChem (CID 158106002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).