6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone

C128H122Br6Cl6F6N14O17S3 — CID 159676214

IUPAC6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone
SMILESCC(C)Cn1cnc2c(F)c(Cc3ccc(Br)cc3Cl)c(C(=O)COCCO)cc21.CSCCOCC(=O)c1cc2c(ncn2C)c(F)c1Cc1ccc(Br)cc1Cl.Cn1cnc2c(F)c(Cc3ccc(Br)cc3Cl)c(C(=O)COCCS(C)(=O)=O)cc21.Cn1cnc2c(F)c(Cc3ccc(Br)cc3Cl)c(C(=O)COCCSc3ccccc3)cc21.Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(C(=O)NOCC(C)(C)O)cc21.O=C(COCCO)c1cc2c(ncn2CC2CC2)c(F)c1Cc1ccc(Br)cc1Cl
InChIInChI=1S/C25H21BrClFN2O2S.C22H21BrClFN2O3.C22H23BrClFN2O3.C20H19BrClFN2O4S.C20H19BrClFN2O2S.C19H19BrClFN4O3/c1-30-15-29-25-22(30)13-19(20(24(25)28)11-16-7-8-17(26)12-21(16)27)23(31)14-32-9-10-33-18-5-3-2-4-6-18;23-15-4-3-14(18(24)8-15)7-17-16(20(29)11-30-6-5-28)9-19-22(21(17)25)26-12-27(19)10-13-1-2-13;1-13(2)10-27-12-26-22-19(27)9-16(20(29)11-30-6-5-28)17(21(22)25)7-14-3-4-15(23)8-18(14)24;1-25-11-24-20-17(25)9-14(18(26)10-29-5-6-30(2,27)28)15(19(20)23)7-12-3-4-13(21)8-16(12)22;1-25-11-24-20-17(25)9-14(18(26)10-27-5-6-28-2)15(19(20)23)7-12-3-4-13(21)8-16(12)22;1-19(2,28)8-29-25-18(27)11-7-14-17(23-9-26(14)3)15(22)16(11)24-13-5-4-10(20)6-12(13)21/h2-8,12-13,15H,9-11,14H2,1H3;3-4,8-9,12-13,28H,1-2,5-7,10-11H2;3-4,8-9,12-13,28H,5-7,10-11H2,1-2H3;3-4,8-9,11H,5-7,10H2,1-2H3;3-4,8-9,11H,5-7,10H2,1-2H3;4-7,9,24,28H,8H2,1-3H3,(H,25,27)
InChIKeyMUPYTAMNZCWERY-UHFFFAOYSA-N
MW3030.80 g/mol
LogP30.07
Rot. Bonds49

About 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone

6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone (PubChem CID 159676214) has the molecular formula C128H122Br6Cl6F6N14O17S3 and a molecular weight of 3030.80 g/mol. Its IUPAC name is 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone.

Molecular Properties

Compound Name6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone
PubChem CID159676214
Molecular FormulaC128H122Br6Cl6F6N14O17S3
Molecular Weight3030.80 g/mol
Exact Mass3020.14
IUPAC Name6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone
SMILESCC(C)Cn1cnc2c(F)c(Cc3ccc(Br)cc3Cl)c(C(=O)COCCO)cc21.CSCCOCC(=O)c1cc2c(ncn2C)c(F)c1Cc1ccc(Br)cc1Cl.Cn1cnc2c(F)c(Cc3ccc(Br)cc3Cl)c(C(=O)COCCS(C)(=O)=O)cc21.Cn1cnc2c(F)c(Cc3ccc(Br)cc3Cl)c(C(=O)COCCSc3ccccc3)cc21.Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(C(=O)NOCC(C)(C)O)cc21.O=C(COCCO)c1cc2c(ncn2CC2CC2)c(F)c1Cc1ccc(Br)cc1Cl
InChIInChI=1S/C25H21BrClFN2O2S.C22H21BrClFN2O3.C22H23BrClFN2O3.C20H19BrClFN2O4S.C20H19BrClFN2O2S.C19H19BrClFN4O3/c1-30-15-29-25-22(30)13-19(20(24(25)28)11-16-7-8-17(26)12-21(16)27)23(31)14-32-9-10-33-18-5-3-2-4-6-18;23-15-4-3-14(18(24)8-15)7-17-16(20(29)11-30-6-5-28)9-19-22(21(17)25)26-12-27(19)10-13-1-2-13;1-13(2)10-27-12-26-22-19(27)9-16(20(29)11-30-6-5-28)17(21(22)25)7-14-3-4-15(23)8-18(14)24;1-25-11-24-20-17(25)9-14(18(26)10-29-5-6-30(2,27)28)15(19(20)23)7-12-3-4-13(21)8-16(12)22;1-25-11-24-20-17(25)9-14(18(26)10-27-5-6-28-2)15(19(20)23)7-12-3-4-13(21)8-16(12)22;1-19(2,28)8-29-25-18(27)11-7-14-17(23-9-26(14)3)15(22)16(11)24-13-5-4-10(20)6-12(13)21/h2-8,12-13,15H,9-11,14H2,1H3;3-4,8-9,12-13,28H,1-2,5-7,10-11H2;3-4,8-9,12-13,28H,5-7,10-11H2,1-2H3;3-4,8-9,11H,5-7,10H2,1-2H3;3-4,8-9,11H,5-7,10H2,1-2H3;4-7,9,24,28H,8H2,1-3H3,(H,25,27)
InChIKeyMUPYTAMNZCWERY-UHFFFAOYSA-N
XLogP30.07
TPSA383.61 Ų
H-Bond Donors5
H-Bond Acceptors32
Rotatable Bonds49
Heavy Atoms180
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003030.80
LogP ≤ 530.07
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

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

Analyze 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone with MolForge

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Related Compounds

1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(piperidin-4-ylmethyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone
CID 58324311
6-(4-bromo-2-chloroanilino)-3-(4-ethoxybutyl)-7-fluoro-N-(2-hydroxyethoxy)benzimidazole-5-carboxamide
CID 89134708
6-(4-bromo-2-chloroanilino)-N-(cyclopropylmethoxy)-7-fluoro-3-propylbenzimidazole-5-carboxamide
CID 59792638
6-(4-bromo-2-chloroanilino)-7-fluoro-3-(2-methylsulfonylethyl)benzimidazole-5-carboxylic acid
CID 11466009
6-(4-bromo-2-chloroanilino)-7-fluoro-N-[2-[6-(hydroxyamino)-6-oxohexoxy]ethoxy]-3-methylbenzimidazole-5-carboxamide
CID 25224674
1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-morpholin-4-ylethoxy)ethanone
CID 58324213
6-(4-bromo-2-chloroanilino)-3-(3-chloropropyl)-N-(cyclopropylmethoxy)-7-fluorobenzimidazole-5-carboxamide
CID 11398438
6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylsulfonylethyl)benzimidazole-5-carboxylic acid
CID 58324337
2-amino-1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylsulfonylethyl)benzimidazol-5-yl]ethanone;6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylsulfonylethyl)benzimidazole-5-carboxylic acid;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylsulfonylethyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;5-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylsulfonylethyl)benzimidazol-5-yl]-1,3,4-oxadiazol-2-amine;6-[(4-bromo-2-methylphenyl)methyl]-7-fluoro-3-(2-methylsulfonylethyl)benzimidazole-5-carboxylic acid;methyl 6-[(4-bromo-2-methylphenyl)methyl]-7-fluoro-3-(2-methylsulfonylethyl)benzimidazole-5-carboxylate
CID 158206967
1-[3-[2-(benzenesulfonyl)ethyl]-6-[(4-bromo-2-methylphenyl)methyl]-7-fluorobenzimidazol-5-yl]-2-(cyclopropylmethoxy)ethanone
CID 58324338
6-[(4-bromo-2-fluorophenyl)methyl]-7-fluoro-N-(2-hydroxyethoxy)-3-methylbenzimidazole-5-carboxamide
CID 148792265
6-(4-bromo-2-chloroanilino)-N-(cyclobutylmethoxy)-7-fluoro-3-methylbenzimidazole-5-carboxamide;2-ethyl-1,3-dioxolane
CID 143014359

Frequently Asked Questions

What is the IUPAC name of 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone?
The IUPAC name of 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone (CID 159676214) is 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone.
What is the SMILES notation for 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone?
The canonical SMILES for 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone is CC(C)Cn1cnc2c(F)c(Cc3ccc(Br)cc3Cl)c(C(=O)COCCO)cc21.CSCCOCC(=O)c1cc2c(ncn2C)c(F)c1Cc1ccc(Br)cc1Cl.Cn1cnc2c(F)c(Cc3ccc(Br)cc3Cl)c(C(=O)COCCS(C)(=O)=O)cc21.Cn1cnc2c(F)c(Cc3ccc(Br)cc3Cl)c(C(=O)COCCSc3ccccc3)cc21.Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(C(=O)NOCC(C)(C)O)cc21.O=C(COCCO)c1cc2c(ncn2CC2CC2)c(F)c1Cc1ccc(Br)cc1Cl.
What is the InChIKey of 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone?
The InChIKey is MUPYTAMNZCWERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21BrClFN2O2S.C22H21BrClFN2O3.C22H23BrClFN2O3.C20H19BrClFN2O4S.C20H19BrClFN2O2S.C19H19BrClFN4O3/c1-30-15-29-25-22(30)13-19(20(24(25)28)11-16-7-8-17(26)12-21(16)27)23(31)14-32-9-10-33-18-5-3-2-4-6-18;23-15-4-3-14(18(24)8-15)7-17-16(20(29)11-30-6-5-28)9-19-22(21(17)25)26-12-27(19)10-13-1-2-13;1-13(2)10-27-12-26-22-19(27)9-16(20(29)11-30-6-5-28)17(21(22)25)7-14-3-4-15(23)8-18(14)24;1-25-11-24-20-17(25)9-14(18(26)10-29-5-6-30(2,27)28)15(19(20)23)7-12-3-4-13(21)8-16(12)22;1-25-11-24-20-17(25)9-14(18(26)10-27-5-6-28-2)15(19(20)23)7-12-3-4-13(21)8-16(12)22;1-19(2,28)8-29-25-18(27)11-7-14-17(23-9-26(14)3)15(22)16(11)24-13-5-4-10(20)6-12(13)21/h2-8,12-13,15H,9-11,14H2,1H3;3-4,8-9,12-13,28H,1-2,5-7,10-11H2;3-4,8-9,12-13,28H,5-7,10-11H2,1-2H3;3-4,8-9,11H,5-7,10H2,1-2H3;3-4,8-9,11H,5-7,10H2,1-2H3;4-7,9,24,28H,8H2,1-3H3,(H,25,27).
What are the key properties of 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone?
6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone has a molecular weight of 3030.80 g/mol, XLogP of 30.07, 49 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxy-2-methylpropoxy)-3-methylbenzimidazole-5-carboxamide;1-[6-[(4-bromo-2-chlorophenyl)methyl]-3-(cyclopropylmethyl)-7-fluorobenzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-methylsulfonylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-methylbenzimidazol-5-yl]-2-(2-phenylsulfanylethoxy)ethanone;1-[6-[(4-bromo-2-chlorophenyl)methyl]-7-fluoro-3-(2-methylpropyl)benzimidazol-5-yl]-2-(2-hydroxyethoxy)ethanone is sourced from PubChem (CID 159676214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).