N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide

C122H86ClF16N37O9S — CID 158770022

IUPACN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide
SMILESCc1cc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2cc1Cl.Cc1cc2nc(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)[nH]c2cc1C.Cc1ccc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2c1C.Cc1noc(C)c1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.O=C(Nc1cn[nH]c1-c1nc2c(C(F)(F)F)cc(C(F)(F)F)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccc(O)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1nccs1
InChIInChI=1S/C19H9F8N5O.2C19H15F2N5O.C18H12ClF2N5O.C17H11F2N5O2.C16H14N6O2.C14H10N6OS/c20-9-2-1-3-10(21)13(9)17(33)30-12-6-28-32-15(12)16-29-11-5-7(18(22,23)24)4-8(14(11)31-16)19(25,26)27;1-9-6-13-14(7-10(9)2)24-18(23-13)17-15(8-22-26-17)25-19(27)16-11(20)4-3-5-12(16)21;1-9-6-7-13-16(10(9)2)25-18(23-13)17-14(8-22-26-17)24-19(27)15-11(20)4-3-5-12(15)21;1-8-5-12-13(6-9(8)19)24-17(23-12)16-14(7-22-26-16)25-18(27)15-10(20)3-2-4-11(15)21;18-9-2-1-3-10(19)14(9)17(26)23-13-7-20-24-15(13)16-21-11-5-4-8(25)6-12(11)22-16;1-8-13(9(2)24-22-8)16(23)20-12-7-17-21-14(12)15-18-10-5-3-4-6-11(10)19-15;21-13(14-15-5-6-22-14)19-10-7-16-20-11(10)12-17-8-3-1-2-4-9(8)18-12/h1-6H,(H,28,32)(H,29,31)(H,30,33);3-8H,1-2H3,(H,22,26)(H,23,24)(H,25,27);3-8H,1-2H3,(H,22,26)(H,23,25)(H,24,27);2-7H,1H3,(H,22,26)(H,23,24)(H,25,27);1-7,25H,(H,20,24)(H,21,22)(H,23,26);3-7H,1-2H3,(H,17,21)(H,18,19)(H,20,23);1-7H,(H,16,20)(H,17,18)(H,19,21)
InChIKeyIPTCHFVLPSTZAA-UHFFFAOYSA-N
MW2585.77 g/mol
LogP26.83
Rot. Bonds21

About N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide (PubChem CID 158770022) has the molecular formula C122H86ClF16N37O9S and a molecular weight of 2585.77 g/mol. Its IUPAC name is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide.

Molecular Properties

Compound NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide
PubChem CID158770022
Molecular FormulaC122H86ClF16N37O9S
Molecular Weight2585.77 g/mol
Exact Mass2583.66
IUPAC NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide
SMILESCc1cc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2cc1Cl.Cc1cc2nc(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)[nH]c2cc1C.Cc1ccc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2c1C.Cc1noc(C)c1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.O=C(Nc1cn[nH]c1-c1nc2c(C(F)(F)F)cc(C(F)(F)F)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccc(O)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1nccs1
InChIInChI=1S/C19H9F8N5O.2C19H15F2N5O.C18H12ClF2N5O.C17H11F2N5O2.C16H14N6O2.C14H10N6OS/c20-9-2-1-3-10(21)13(9)17(33)30-12-6-28-32-15(12)16-29-11-5-7(18(22,23)24)4-8(14(11)31-16)19(25,26)27;1-9-6-13-14(7-10(9)2)24-18(23-13)17-15(8-22-26-17)25-19(27)16-11(20)4-3-5-12(16)21;1-9-6-7-13-16(10(9)2)25-18(23-13)17-14(8-22-26-17)24-19(27)15-11(20)4-3-5-12(15)21;1-8-5-12-13(6-9(8)19)24-17(23-12)16-14(7-22-26-16)25-18(27)15-10(20)3-2-4-11(15)21;18-9-2-1-3-10(19)14(9)17(26)23-13-7-20-24-15(13)16-21-11-5-4-8(25)6-12(11)22-16;1-8-13(9(2)24-22-8)16(23)20-12-7-17-21-14(12)15-18-10-5-3-4-6-11(10)19-15;21-13(14-15-5-6-22-14)19-10-7-16-20-11(10)12-17-8-3-1-2-4-9(8)18-12/h1-6H,(H,28,32)(H,29,31)(H,30,33);3-8H,1-2H3,(H,22,26)(H,23,24)(H,25,27);3-8H,1-2H3,(H,22,26)(H,23,25)(H,24,27);2-7H,1H3,(H,22,26)(H,23,24)(H,25,27);1-7,25H,(H,20,24)(H,21,22)(H,23,26);3-7H,1-2H3,(H,17,21)(H,18,19)(H,20,23);1-7H,(H,16,20)(H,17,18)(H,19,21)
InChIKeyIPTCHFVLPSTZAA-UHFFFAOYSA-N
XLogP26.83
TPSA664.37 Ų
H-Bond Donors22
H-Bond Acceptors26
Rotatable Bonds21
Heavy Atoms186
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002585.77
LogP ≤ 526.83
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1026

Analyze N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide with MolForge

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Related Compounds

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dichloro-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide
CID 158357528
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
CID 158419041
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dichloro-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide
CID 160041304
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethyl-1,3-thiazole-5-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-[4-chloro-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide
CID 161358595
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(5,6-dichloro-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide
CID 157732352
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide
CID 162000035

Frequently Asked Questions

What is the IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide?
The IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide (CID 158770022) is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide.
What is the SMILES notation for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide?
The canonical SMILES for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide is Cc1cc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2cc1Cl.Cc1cc2nc(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)[nH]c2cc1C.Cc1ccc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2c1C.Cc1noc(C)c1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.O=C(Nc1cn[nH]c1-c1nc2c(C(F)(F)F)cc(C(F)(F)F)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccc(O)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1nccs1.
What is the InChIKey of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide?
The InChIKey is IPTCHFVLPSTZAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H9F8N5O.2C19H15F2N5O.C18H12ClF2N5O.C17H11F2N5O2.C16H14N6O2.C14H10N6OS/c20-9-2-1-3-10(21)13(9)17(33)30-12-6-28-32-15(12)16-29-11-5-7(18(22,23)24)4-8(14(11)31-16)19(25,26)27;1-9-6-13-14(7-10(9)2)24-18(23-13)17-15(8-22-26-17)25-19(27)16-11(20)4-3-5-12(16)21;1-9-6-7-13-16(10(9)2)25-18(23-13)17-14(8-22-26-17)24-19(27)15-11(20)4-3-5-12(15)21;1-8-5-12-13(6-9(8)19)24-17(23-12)16-14(7-22-26-16)25-18(27)15-10(20)3-2-4-11(15)21;18-9-2-1-3-10(19)14(9)17(26)23-13-7-20-24-15(13)16-21-11-5-4-8(25)6-12(11)22-16;1-8-13(9(2)24-22-8)16(23)20-12-7-17-21-14(12)15-18-10-5-3-4-6-11(10)19-15;21-13(14-15-5-6-22-14)19-10-7-16-20-11(10)12-17-8-3-1-2-4-9(8)18-12/h1-6H,(H,28,32)(H,29,31)(H,30,33);3-8H,1-2H3,(H,22,26)(H,23,24)(H,25,27);3-8H,1-2H3,(H,22,26)(H,23,25)(H,24,27);2-7H,1H3,(H,22,26)(H,23,24)(H,25,27);1-7,25H,(H,20,24)(H,21,22)(H,23,26);3-7H,1-2H3,(H,17,21)(H,18,19)(H,20,23);1-7H,(H,16,20)(H,17,18)(H,19,21).
What are the key properties of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide?
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide has a molecular weight of 2585.77 g/mol, XLogP of 26.83, 21 rotatable bonds, 22 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide is sourced from PubChem (CID 158770022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).