4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole

C173H189Cl8N43O8 — CID 158741921

IUPAC4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole
SMILESC=C1CC2(CCN(c3cc(-c4nc5ccccc5n4C)c(Cl)cn3)CC2)CN1C.CCCOC1CCN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)CC1.CC[C@@H]1CN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)C[C@@H]1CO.COCCc1nnc2n1CCN(c1cc(-c3nc4ccccc4n3C)c(Cl)cn1)C2.Cn1c(-c2cc(N3CCC(C(=O)N4CCCCC4)CC3)ncc2Cl)nc2ccccc21.Cn1c(-c2cc(N3CCC(N4CCCC4=O)CC3)ncc2Cl)nc2ccccc21.Cn1c(-c2cc(N3CCOC(c4nc(C5CC5)no4)C3)ncc2Cl)nc2ccccc21.Cn1nc2n(c1=O)CCN(c1cc(-c3nc4ccccc4n3C)c(Cl)cn1)CC2
InChIInChI=1S/C24H28ClN5O.C23H26ClN5.C22H21ClN6O2.C22H24ClN5O.C21H22ClN7O.C21H25ClN4O.C20H20ClN7O.C20H23ClN4O/c1-28-21-8-4-3-7-20(21)27-23(28)18-15-22(26-16-19(18)25)29-13-9-17(10-14-29)24(31)30-11-5-2-6-12-30;1-16-13-23(15-27(16)2)8-10-29(11-9-23)21-12-17(18(24)14-25-21)22-26-19-6-4-5-7-20(19)28(22)3;1-28-17-5-3-2-4-16(17)25-21(28)14-10-19(24-11-15(14)23)29-8-9-30-18(12-29)22-26-20(27-31-22)13-6-7-13;1-26-19-6-3-2-5-18(19)25-22(26)16-13-20(24-14-17(16)23)27-11-8-15(9-12-27)28-10-4-7-21(28)29;1-27-17-6-4-3-5-16(17)24-21(27)14-11-19(23-12-15(14)22)28-8-9-29-18(7-10-30-2)25-26-20(29)13-28;1-3-12-27-15-8-10-26(11-9-15)20-13-16(17(22)14-23-20)21-24-18-6-4-5-7-19(18)25(21)2;1-25-16-6-4-3-5-15(16)23-19(25)13-11-18(22-12-14(13)21)27-8-7-17-24-26(2)20(29)28(17)10-9-27;1-3-13-10-25(11-14(13)12-26)19-8-15(16(21)9-22-19)20-23-17-6-4-5-7-18(17)24(20)2/h3-4,7-8,15-17H,2,5-6,9-14H2,1H3;4-7,12,14H,1,8-11,13,15H2,2-3H3;2-5,10-11,13,18H,6-9,12H2,1H3;2-3,5-6,13-15H,4,7-12H2,1H3;3-6,11-12H,7-10,13H2,1-2H3;4-7,13-15H,3,8-12H2,1-2H3;3-6,11-12H,7-10H2,1-2H3;4-9,13-14,26H,3,10-12H2,1-2H3/t;;;;;;;13-,14-/m.......1/s1
InChIKeyIMKBRBUUEFWWMP-OFAPSTGGSA-N
MW3282.33 g/mol
LogP31.01
Rot. Bonds28

About 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole

4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole (PubChem CID 158741921) has the molecular formula C173H189Cl8N43O8 and a molecular weight of 3282.33 g/mol. Its IUPAC name is 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole.

Molecular Properties

Compound Name4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole
PubChem CID158741921
Molecular FormulaC173H189Cl8N43O8
Molecular Weight3282.33 g/mol
Exact Mass3276.32
IUPAC Name4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole
SMILESC=C1CC2(CCN(c3cc(-c4nc5ccccc5n4C)c(Cl)cn3)CC2)CN1C.CCCOC1CCN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)CC1.CC[C@@H]1CN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)C[C@@H]1CO.COCCc1nnc2n1CCN(c1cc(-c3nc4ccccc4n3C)c(Cl)cn1)C2.Cn1c(-c2cc(N3CCC(C(=O)N4CCCCC4)CC3)ncc2Cl)nc2ccccc21.Cn1c(-c2cc(N3CCC(N4CCCC4=O)CC3)ncc2Cl)nc2ccccc21.Cn1c(-c2cc(N3CCOC(c4nc(C5CC5)no4)C3)ncc2Cl)nc2ccccc21.Cn1nc2n(c1=O)CCN(c1cc(-c3nc4ccccc4n3C)c(Cl)cn1)CC2
InChIInChI=1S/C24H28ClN5O.C23H26ClN5.C22H21ClN6O2.C22H24ClN5O.C21H22ClN7O.C21H25ClN4O.C20H20ClN7O.C20H23ClN4O/c1-28-21-8-4-3-7-20(21)27-23(28)18-15-22(26-16-19(18)25)29-13-9-17(10-14-29)24(31)30-11-5-2-6-12-30;1-16-13-23(15-27(16)2)8-10-29(11-9-23)21-12-17(18(24)14-25-21)22-26-19-6-4-5-7-20(19)28(22)3;1-28-17-5-3-2-4-16(17)25-21(28)14-10-19(24-11-15(14)23)29-8-9-30-18(12-29)22-26-20(27-31-22)13-6-7-13;1-26-19-6-3-2-5-18(19)25-22(26)16-13-20(24-14-17(16)23)27-11-8-15(9-12-27)28-10-4-7-21(28)29;1-27-17-6-4-3-5-16(17)24-21(27)14-11-19(23-12-15(14)22)28-8-9-29-18(7-10-30-2)25-26-20(29)13-28;1-3-12-27-15-8-10-26(11-9-15)20-13-16(17(22)14-23-20)21-24-18-6-4-5-7-19(18)25(21)2;1-25-16-6-4-3-5-15(16)23-19(25)13-11-18(22-12-14(13)21)27-8-7-17-24-26(2)20(29)28(17)10-9-27;1-3-13-10-25(11-14(13)12-26)19-8-15(16(21)9-22-19)20-23-17-6-4-5-7-18(17)24(20)2/h3-4,7-8,15-17H,2,5-6,9-14H2,1H3;4-7,12,14H,1,8-11,13,15H2,2-3H3;2-5,10-11,13,18H,6-9,12H2,1H3;2-3,5-6,13-15H,4,7-12H2,1H3;3-6,11-12H,7-10,13H2,1-2H3;4-7,13-15H,3,8-12H2,1-2H3;3-6,11-12H,7-10H2,1-2H3;4-9,13-14,26H,3,10-12H2,1-2H3/t;;;;;;;13-,14-/m.......1/s1
InChIKeyIMKBRBUUEFWWMP-OFAPSTGGSA-N
XLogP31.01
TPSA472.83 Ų
H-Bond Donors1
H-Bond Acceptors49
Rotatable Bonds28
Heavy Atoms232
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003282.33
LogP ≤ 531.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1049

Analyze 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole?
The IUPAC name of 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole (CID 158741921) is 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole.
What is the SMILES notation for 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole?
The canonical SMILES for 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole is C=C1CC2(CCN(c3cc(-c4nc5ccccc5n4C)c(Cl)cn3)CC2)CN1C.CCCOC1CCN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)CC1.CC[C@@H]1CN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)C[C@@H]1CO.COCCc1nnc2n1CCN(c1cc(-c3nc4ccccc4n3C)c(Cl)cn1)C2.Cn1c(-c2cc(N3CCC(C(=O)N4CCCCC4)CC3)ncc2Cl)nc2ccccc21.Cn1c(-c2cc(N3CCC(N4CCCC4=O)CC3)ncc2Cl)nc2ccccc21.Cn1c(-c2cc(N3CCOC(c4nc(C5CC5)no4)C3)ncc2Cl)nc2ccccc21.Cn1nc2n(c1=O)CCN(c1cc(-c3nc4ccccc4n3C)c(Cl)cn1)CC2.
What is the InChIKey of 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole?
The InChIKey is IMKBRBUUEFWWMP-OFAPSTGGSA-N. The full InChI is InChI=1S/C24H28ClN5O.C23H26ClN5.C22H21ClN6O2.C22H24ClN5O.C21H22ClN7O.C21H25ClN4O.C20H20ClN7O.C20H23ClN4O/c1-28-21-8-4-3-7-20(21)27-23(28)18-15-22(26-16-19(18)25)29-13-9-17(10-14-29)24(31)30-11-5-2-6-12-30;1-16-13-23(15-27(16)2)8-10-29(11-9-23)21-12-17(18(24)14-25-21)22-26-19-6-4-5-7-20(19)28(22)3;1-28-17-5-3-2-4-16(17)25-21(28)14-10-19(24-11-15(14)23)29-8-9-30-18(12-29)22-26-20(27-31-22)13-6-7-13;1-26-19-6-3-2-5-18(19)25-22(26)16-13-20(24-14-17(16)23)27-11-8-15(9-12-27)28-10-4-7-21(28)29;1-27-17-6-4-3-5-16(17)24-21(27)14-11-19(23-12-15(14)22)28-8-9-29-18(7-10-30-2)25-26-20(29)13-28;1-3-12-27-15-8-10-26(11-9-15)20-13-16(17(22)14-23-20)21-24-18-6-4-5-7-19(18)25(21)2;1-25-16-6-4-3-5-15(16)23-19(25)13-11-18(22-12-14(13)21)27-8-7-17-24-26(2)20(29)28(17)10-9-27;1-3-13-10-25(11-14(13)12-26)19-8-15(16(21)9-22-19)20-23-17-6-4-5-7-18(17)24(20)2/h3-4,7-8,15-17H,2,5-6,9-14H2,1H3;4-7,12,14H,1,8-11,13,15H2,2-3H3;2-5,10-11,13,18H,6-9,12H2,1H3;2-3,5-6,13-15H,4,7-12H2,1H3;3-6,11-12H,7-10,13H2,1-2H3;4-7,13-15H,3,8-12H2,1-2H3;3-6,11-12H,7-10H2,1-2H3;4-9,13-14,26H,3,10-12H2,1-2H3/t;;;;;;;13-,14-/m.......1/s1.
What are the key properties of 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole?
4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole has a molecular weight of 3282.33 g/mol, XLogP of 31.01, 28 rotatable bonds, 1 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholine;[(3R,4S)-1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-4-ethylpyrrolidin-3-yl]methanol;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-3-(2-methoxyethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;8-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-3-methylidene-2,8-diazaspiro[4.5]decane;7-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-2-methyl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one;[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]-piperidin-1-ylmethanone;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one;2-[5-chloro-2-(4-propoxypiperidin-1-yl)-4-pyridinyl]-1-methylbenzimidazole is sourced from PubChem (CID 158741921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).