2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole

C152H143Cl4F4N13O7 — CID 158694961

IUPAC2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole
SMILESCC1CC(Oc2nc3cc(-c4ccc(-c5ccccc5O)cc4)c(Cl)cc3[nH]2)C1.CC1CCC(Oc2nc3c(F)c(-c4ccc(-c5ccccc5)cc4)c(F)cc3[nH]2)CC1.CC1CCC(Oc2nc3c(F)c(-c4ccc5c(ccn5C5CC5)c4)c(F)cc3[nH]2)CC1.CC1CCC(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(Cl)cc3[nH]2)C1.CC1CCC(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(Cl)cc3[nH]2)CC1.CC1CCCC(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(Cl)cc3[nH]2)C1
InChIInChI=1S/2C26H25ClN2O.C26H24F2N2O.C25H23ClN2O.C25H25F2N3O.C24H21ClN2O2/c1-17-6-5-9-21(14-17)30-26-28-24-15-22(23(27)16-25(24)29-26)20-12-10-19(11-13-20)18-7-3-2-4-8-18;1-17-7-13-21(14-8-17)30-26-28-24-15-22(23(27)16-25(24)29-26)20-11-9-19(10-12-20)18-5-3-2-4-6-18;1-16-7-13-20(14-8-16)31-26-29-22-15-21(27)23(24(28)25(22)30-26)19-11-9-18(10-12-19)17-5-3-2-4-6-17;1-16-7-12-20(13-16)29-25-27-23-14-21(22(26)15-24(23)28-25)19-10-8-18(9-11-19)17-5-3-2-4-6-17;1-14-2-7-18(8-3-14)31-25-28-20-13-19(26)22(23(27)24(20)29-25)16-4-9-21-15(12-16)10-11-30(21)17-5-6-17;1-14-10-17(11-14)29-24-26-21-12-19(20(25)13-22(21)27-24)16-8-6-15(7-9-16)18-4-2-3-5-23(18)28/h2-4,7-8,10-13,15-17,21H,5-6,9,14H2,1H3,(H,28,29);2-6,9-12,15-17,21H,7-8,13-14H2,1H3,(H,28,29);2-6,9-12,15-16,20H,7-8,13-14H2,1H3,(H,29,30);2-6,8-11,14-16,20H,7,12-13H2,1H3,(H,27,28);4,9-14,17-18H,2-3,5-8H2,1H3,(H,28,29);2-9,12-14,17,28H,10-11H2,1H3,(H,26,27)
InChIKeyIGUYWOOQDUPQRD-UHFFFAOYSA-N
MW2481.70 g/mol
LogP42.45
Rot. Bonds24

About 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole

2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole (PubChem CID 158694961) has the molecular formula C152H143Cl4F4N13O7 and a molecular weight of 2481.70 g/mol. Its IUPAC name is 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole.

Molecular Properties

Compound Name2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole
PubChem CID158694961
Molecular FormulaC152H143Cl4F4N13O7
Molecular Weight2481.70 g/mol
Exact Mass2477.99
IUPAC Name2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole
SMILESCC1CC(Oc2nc3cc(-c4ccc(-c5ccccc5O)cc4)c(Cl)cc3[nH]2)C1.CC1CCC(Oc2nc3c(F)c(-c4ccc(-c5ccccc5)cc4)c(F)cc3[nH]2)CC1.CC1CCC(Oc2nc3c(F)c(-c4ccc5c(ccn5C5CC5)c4)c(F)cc3[nH]2)CC1.CC1CCC(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(Cl)cc3[nH]2)C1.CC1CCC(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(Cl)cc3[nH]2)CC1.CC1CCCC(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(Cl)cc3[nH]2)C1
InChIInChI=1S/2C26H25ClN2O.C26H24F2N2O.C25H23ClN2O.C25H25F2N3O.C24H21ClN2O2/c1-17-6-5-9-21(14-17)30-26-28-24-15-22(23(27)16-25(24)29-26)20-12-10-19(11-13-20)18-7-3-2-4-8-18;1-17-7-13-21(14-8-17)30-26-28-24-15-22(23(27)16-25(24)29-26)20-11-9-19(10-12-20)18-5-3-2-4-6-18;1-16-7-13-20(14-8-16)31-26-29-22-15-21(27)23(24(28)25(22)30-26)19-11-9-18(10-12-19)17-5-3-2-4-6-17;1-16-7-12-20(13-16)29-25-27-23-14-21(22(26)15-24(23)28-25)19-10-8-18(9-11-19)17-5-3-2-4-6-17;1-14-2-7-18(8-3-14)31-25-28-20-13-19(26)22(23(27)24(20)29-25)16-4-9-21-15(12-16)10-11-30(21)17-5-6-17;1-14-10-17(11-14)29-24-26-21-12-19(20(25)13-22(21)27-24)16-8-6-15(7-9-16)18-4-2-3-5-23(18)28/h2-4,7-8,10-13,15-17,21H,5-6,9,14H2,1H3,(H,28,29);2-6,9-12,15-17,21H,7-8,13-14H2,1H3,(H,28,29);2-6,9-12,15-16,20H,7-8,13-14H2,1H3,(H,29,30);2-6,8-11,14-16,20H,7,12-13H2,1H3,(H,27,28);4,9-14,17-18H,2-3,5-8H2,1H3,(H,28,29);2-9,12-14,17,28H,10-11H2,1H3,(H,26,27)
InChIKeyIGUYWOOQDUPQRD-UHFFFAOYSA-N
XLogP42.45
TPSA252.62 Ų
H-Bond Donors7
H-Bond Acceptors14
Rotatable Bonds24
Heavy Atoms180
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002481.70
LogP ≤ 542.45
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1014

Analyze 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole with MolForge

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Related Compounds

6-chloro-5-(4-cyclopropylphenyl)-2-(3,4-dimethylphenoxy)-1H-benzimidazole;2-[5-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]-6-fluoroindol-1-yl]ethanol;2-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]propan-2-ol;5-chloro-2-(3,4-dimethylphenoxy)-6-[2-(2-fluorophenyl)ethynyl]-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(1-methylindol-5-yl)-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(4-phenylphenyl)-1H-benzimidazole;2-[4-[2-(3,4-dimethylphenoxy)-6-fluoro-1H-benzimidazol-5-yl]phenyl]phenol
CID 157439692
[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]-3-fluorophenyl]methanol;[1-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]cyclopropyl]methanol;6-chloro-2-(3,4-dimethylphenoxy)-5-(4-pyrrolidin-1-ylphenyl)-1H-benzimidazole;2-(3,4-dimethylphenoxy)-4,6-difluoro-5-(1-methylindol-5-yl)-1H-benzimidazole;[4-[4-[2-(3,4-dimethylphenoxy)-6-fluoro-1H-benzimidazol-5-yl]phenyl]phenyl]methanol;methane
CID 157655443
5-[[6-chloro-5-(4-cyclopropylphenyl)-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-chloro-5-[6-fluoro-1-(2-hydroxyethyl)indol-5-yl]-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[5-chloro-6-[2-(2-fluorophenyl)ethynyl]-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-chloro-5-[4-(2-hydroxypropan-2-yl)phenyl]-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-chloro-5-(1-methylindol-5-yl)-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-chloro-5-(4-phenylphenyl)-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-fluoro-5-[4-(2-hydroxyphenyl)phenyl]-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid
CID 158141354
[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]-3-fluorophenyl]methanol;[1-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]cyclopropyl]methanol;5-chloro-2-(3,4-dimethylphenoxy)-6-[2-(2-fluorophenyl)ethynyl]-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(4-pyrrolidin-1-ylphenyl)-1H-benzimidazole;2-(3,4-dimethylphenoxy)-4,6-difluoro-5-(1-methylindol-5-yl)-1H-benzimidazole;[4-[4-[2-(3,4-dimethylphenoxy)-6-fluoro-1H-benzimidazol-5-yl]phenyl]phenyl]methanol;methane
CID 158232654
6-chloro-5-(4-cyclopropylphenyl)-2-(3,4-dimethylphenoxy)-1H-benzimidazole;2-[5-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]-6-fluoroindol-1-yl]ethanol;2-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]phenol;2-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]propan-2-ol;6-chloro-2-(3,4-dimethylphenoxy)-5-(1-methylindol-5-yl)-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(4-phenylphenyl)-1H-benzimidazole
CID 158690216
6-chloro-5-(4-cyclopropylphenyl)-2-(3,4-dimethylphenoxy)-1H-benzimidazole;2-[5-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]-6-fluoroindol-1-yl]ethanol;2-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]propan-2-ol;6-chloro-2-(3,4-dimethylphenoxy)-5-[4-[2-(2-fluorophenyl)ethynyl]phenyl]-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(1-methylindol-5-yl)-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(4-phenylphenyl)-1H-benzimidazole;2-[4-[2-(3,4-dimethylphenoxy)-6-fluoro-1H-benzimidazol-5-yl]phenyl]phenol
CID 159077364
6-chloro-5-(4-cyclopropylphenyl)-2-(3,4-dimethylphenoxy)-1H-benzimidazole;2-[5-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]-6-fluoroindol-1-yl]ethanol;2-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]propan-2-ol;5-chloro-2-(3,4-dimethylphenoxy)-6-[2-(2-fluorophenyl)ethynyl]-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(1-methylindol-5-yl)-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(4-phenylphenyl)-1H-benzimidazole;2-(3,4-dimethylphenoxy)-4,6-difluoro-5-(1-methylindol-5-yl)-1H-benzimidazole;2-[4-[2-(3,4-dimethylphenoxy)-6-fluoro-1H-benzimidazol-5-yl]phenyl]phenol
CID 159110249
6-chloro-5-(4-cyclopropylphenyl)-2-(3,4-dimethylphenoxy)-1H-benzimidazole;2-[5-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]-6-fluoroindol-1-yl]ethanol;2-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]propan-2-ol;6-chloro-2-(3,4-dimethylphenoxy)-5-(1-methylindol-5-yl)-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(4-phenylphenyl)-1H-benzimidazole;2-[4-[2-(3,4-dimethylphenoxy)-6-fluoro-1H-benzimidazol-5-yl]phenyl]phenol
CID 159130473
6-chloro-5-(4-cyclopropylphenyl)-2-(3,4-dimethylphenoxy)-1H-benzimidazole;2-[5-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]-6-fluoroindol-1-yl]ethanol;2-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]phenol;2-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]propan-2-ol;5-chloro-2-(3,4-dimethylphenoxy)-6-[2-(2-fluorophenyl)ethynyl]-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(1-methylindol-5-yl)-1H-benzimidazole;6-chloro-2-(3,4-dimethylphenoxy)-5-(4-phenylphenyl)-1H-benzimidazole;2-(3,4-dimethylphenoxy)-4,6-difluoro-5-(1-methylindol-5-yl)-1H-benzimidazole
CID 159296534
carbon dioxide;[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]-3-fluorophenyl]methanol;[1-[4-[6-chloro-2-(3,4-dimethylphenoxy)-1H-benzimidazol-5-yl]phenyl]cyclopropyl]methanol;6-chloro-2-(3,4-dimethylphenoxy)-5-(4-pyrrolidin-1-ylphenyl)-1H-benzimidazole;2-(3,4-dimethylphenoxy)-4,6-difluoro-5-(1-methylindol-5-yl)-1H-benzimidazole;2-(3,4-dimethylphenoxy)-6-fluoro-5-(4-phenylphenyl)-1H-benzimidazole;methane
CID 159300507
[4-[2-(6-chloro-2-ethylsulfanyl-3H-benzimidazol-5-yl)ethynyl]phenyl]methanol;2-[4-(6-chloro-2-ethylsulfanyl-1H-benzimidazol-5-yl)phenyl]phenol;6-chloro-2-ethylsulfanyl-5-(1H-inden-5-yl)-1H-benzimidazole;6-chloro-2-ethylsulfanyl-5-(1-methylindol-5-yl)-1H-benzimidazole;5-chloro-2-ethylsulfanyl-6-(2-phenylethynyl)-1H-benzimidazole;6-chloro-2-ethylsulfanyl-5-(4-phenylphenyl)-1H-benzimidazole
CID 159686292
5-[[6-chloro-5-(4-cyclopropylphenyl)-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-chloro-5-[6-fluoro-1-(2-hydroxyethyl)indol-5-yl]-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-chloro-5-[4-(2-hydroxypropan-2-yl)phenyl]-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-chloro-5-(1-methylindol-5-yl)-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-chloro-5-(4-phenylphenyl)-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid;5-[[6-fluoro-5-[4-(2-hydroxyphenyl)phenyl]-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid
CID 160023855

Frequently Asked Questions

What is the IUPAC name of 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole?
The IUPAC name of 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole (CID 158694961) is 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole.
What is the SMILES notation for 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole?
The canonical SMILES for 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole is CC1CC(Oc2nc3cc(-c4ccc(-c5ccccc5O)cc4)c(Cl)cc3[nH]2)C1.CC1CCC(Oc2nc3c(F)c(-c4ccc(-c5ccccc5)cc4)c(F)cc3[nH]2)CC1.CC1CCC(Oc2nc3c(F)c(-c4ccc5c(ccn5C5CC5)c4)c(F)cc3[nH]2)CC1.CC1CCC(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(Cl)cc3[nH]2)C1.CC1CCC(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(Cl)cc3[nH]2)CC1.CC1CCCC(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(Cl)cc3[nH]2)C1.
What is the InChIKey of 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole?
The InChIKey is IGUYWOOQDUPQRD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H25ClN2O.C26H24F2N2O.C25H23ClN2O.C25H25F2N3O.C24H21ClN2O2/c1-17-6-5-9-21(14-17)30-26-28-24-15-22(23(27)16-25(24)29-26)20-12-10-19(11-13-20)18-7-3-2-4-8-18;1-17-7-13-21(14-8-17)30-26-28-24-15-22(23(27)16-25(24)29-26)20-11-9-19(10-12-20)18-5-3-2-4-6-18;1-16-7-13-20(14-8-16)31-26-29-22-15-21(27)23(24(28)25(22)30-26)19-11-9-18(10-12-19)17-5-3-2-4-6-17;1-16-7-12-20(13-16)29-25-27-23-14-21(22(26)15-24(23)28-25)19-10-8-18(9-11-19)17-5-3-2-4-6-17;1-14-2-7-18(8-3-14)31-25-28-20-13-19(26)22(23(27)24(20)29-25)16-4-9-21-15(12-16)10-11-30(21)17-5-6-17;1-14-10-17(11-14)29-24-26-21-12-19(20(25)13-22(21)27-24)16-8-6-15(7-9-16)18-4-2-3-5-23(18)28/h2-4,7-8,10-13,15-17,21H,5-6,9,14H2,1H3,(H,28,29);2-6,9-12,15-17,21H,7-8,13-14H2,1H3,(H,28,29);2-6,9-12,15-16,20H,7-8,13-14H2,1H3,(H,29,30);2-6,8-11,14-16,20H,7,12-13H2,1H3,(H,27,28);4,9-14,17-18H,2-3,5-8H2,1H3,(H,28,29);2-9,12-14,17,28H,10-11H2,1H3,(H,26,27).
What are the key properties of 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole?
2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole has a molecular weight of 2481.70 g/mol, XLogP of 42.45, 24 rotatable bonds, 7 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[6-chloro-2-(3-methylcyclobutyl)oxy-1H-benzimidazol-5-yl]phenyl]phenol;6-chloro-2-(3-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;6-chloro-2-(3-methylcyclopentyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole;5-(1-cyclopropylindol-5-yl)-4,6-difluoro-2-(4-methylcyclohexyl)oxy-1H-benzimidazole;4,6-difluoro-2-(4-methylcyclohexyl)oxy-5-(4-phenylphenyl)-1H-benzimidazole is sourced from PubChem (CID 158694961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).