(5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole

C111H104F4N12O10 — CID 159914593

IUPAC(5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
SMILESCOc1ccc(COC[C@@H]2CCc3nc(-c4ccc(C)cc4)c(-c4ccncc4)n32)cc1.COc1ccc(COC[C@@H]2CCc3nc(-c4ccc(OC(F)(F)F)cc4)c(-c4ccncc4)n32)cc1.COc1ccc(COC[C@@H]2CCc3nc(-c4ccc5cc(OC)ccc5c4)c(-c4ccncc4)n32)cc1.COc1ccc(COC[C@@H]2CCc3nc(-c4cccc(F)c4)c(-c4ccncc4)n32)cc1
InChIInChI=1S/C31H29N3O3.C27H24F3N3O3.C27H27N3O2.C26H24FN3O2/c1-35-27-9-3-21(4-10-27)19-37-20-26-8-12-29-33-30(31(34(26)29)22-13-15-32-16-14-22)25-6-5-24-18-28(36-2)11-7-23(24)17-25;1-34-22-7-2-18(3-8-22)16-35-17-21-6-11-24-32-25(26(33(21)24)20-12-14-31-15-13-20)19-4-9-23(10-5-19)36-27(28,29)30;1-19-3-7-21(8-4-19)26-27(22-13-15-28-16-14-22)30-23(9-12-25(30)29-26)18-32-17-20-5-10-24(31-2)11-6-20;1-31-23-8-5-18(6-9-23)16-32-17-22-7-10-24-29-25(20-3-2-4-21(27)15-20)26(30(22)24)19-11-13-28-14-12-19/h3-7,9-11,13-18,26H,8,12,19-20H2,1-2H3;2-5,7-10,12-15,21H,6,11,16-17H2,1H3;3-8,10-11,13-16,23H,9,12,17-18H2,1-2H3;2-6,8-9,11-15,22H,7,10,16-17H2,1H3/t26-;21-;23-;22-/m0000/s1
InChIKeyNXPSIOYVPGWXAY-BBYZOBCLSA-N
MW1842.12 g/mol
LogP23.81
Rot. Bonds30

About (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole

(5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole (PubChem CID 159914593) has the molecular formula C111H104F4N12O10 and a molecular weight of 1842.12 g/mol. Its IUPAC name is (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole.

Molecular Properties

Compound Name(5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
PubChem CID159914593
Molecular FormulaC111H104F4N12O10
Molecular Weight1842.12 g/mol
Exact Mass1840.79
IUPAC Name(5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
SMILESCOc1ccc(COC[C@@H]2CCc3nc(-c4ccc(C)cc4)c(-c4ccncc4)n32)cc1.COc1ccc(COC[C@@H]2CCc3nc(-c4ccc(OC(F)(F)F)cc4)c(-c4ccncc4)n32)cc1.COc1ccc(COC[C@@H]2CCc3nc(-c4ccc5cc(OC)ccc5c4)c(-c4ccncc4)n32)cc1.COc1ccc(COC[C@@H]2CCc3nc(-c4cccc(F)c4)c(-c4ccncc4)n32)cc1
InChIInChI=1S/C31H29N3O3.C27H24F3N3O3.C27H27N3O2.C26H24FN3O2/c1-35-27-9-3-21(4-10-27)19-37-20-26-8-12-29-33-30(31(34(26)29)22-13-15-32-16-14-22)25-6-5-24-18-28(36-2)11-7-23(24)17-25;1-34-22-7-2-18(3-8-22)16-35-17-21-6-11-24-32-25(26(33(21)24)20-12-14-31-15-13-20)19-4-9-23(10-5-19)36-27(28,29)30;1-19-3-7-21(8-4-19)26-27(22-13-15-28-16-14-22)30-23(9-12-25(30)29-26)18-32-17-20-5-10-24(31-2)11-6-20;1-31-23-8-5-18(6-9-23)16-32-17-22-7-10-24-29-25(20-3-2-4-21(27)15-20)26(30(22)24)19-11-13-28-14-12-19/h3-7,9-11,13-18,26H,8,12,19-20H2,1-2H3;2-5,7-10,12-15,21H,6,11,16-17H2,1H3;3-8,10-11,13-16,23H,9,12,17-18H2,1-2H3;2-6,8-9,11-15,22H,7,10,16-17H2,1H3/t26-;21-;23-;22-/m0000/s1
InChIKeyNXPSIOYVPGWXAY-BBYZOBCLSA-N
XLogP23.81
TPSA215.14 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds30
Heavy Atoms137
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001842.12
LogP ≤ 523.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole with MolForge

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Related Compounds

6-[4-(3,3-Difluorocyclobutyl)oxy-3-fluorophenyl]-3-(1,1-difluoroethyl)-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[2-(difluoromethoxymethyl)-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[5-fluoro-6-(trifluoromethyl)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[3-methyl-4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(methoxy)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(methoxy)methyl]-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-methyl-6-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrazine
CID 157501665
N-ethyl-4-[(5S)-2-(4-fluorophenyl)-5-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]pyrimidin-2-amine;4-[(5S)-2-(4-fluorophenyl)-5-[[2-methoxyethyl-[(2-methoxyphenyl)methyl]amino]methyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-N-propylpyrimidin-2-amine;4-[(5S)-2-(4-fluorophenyl)-5-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-N-methylpyrimidin-2-amine;4-[(5S)-2-(4-fluorophenyl)-5-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-N-propylpyrimidin-2-amine;4-[(5S)-2-(4-fluorophenyl)-5-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]pyrimidin-2-amine
CID 158456098
(8E)-3-[4-(1,1-difluoroethoxy)phenyl]-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-6,7-dihydro-5H-[1,2,4]oxadiazolo[4,3-a]pyridine;(8E)-3-(3,5-difluoro-4-methylphenyl)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-6,7-dihydro-5H-[1,2,4]oxadiazolo[4,3-a]pyridine;(6R,8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3,6-dimethyl-3-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]oxadiazolo[4,3-a]pyridine;(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-(4-methoxyphenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]oxadiazolo[4,3-a]pyridine;(8E)-8-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-3-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]oxadiazolo[4,3-a]pyridine;(7E)-7-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]-3-methyl-3-(4-methylphenyl)-5,6-dihydropyrrolo[2,1-c][1,2,4]oxadiazole
CID 159047648
(5S)-5-[(2-chloro-6-fluorophenyl)methoxymethyl]-2-(4-fluorophenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-chlorophenyl)methoxymethyl]-2-(4-fluorophenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(4-fluorophenyl)-5-[(3-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(4-fluorophenyl)-5-[(2-methylphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(4-fluorophenyl)-3-pyridin-4-yl-5-[[2-(trifluoromethyl)phenyl]methoxymethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 159849472
(5S)-5-[(2,6-dichlorophenyl)methoxymethyl]-2-(4-fluorophenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(4-fluorophenyl)-5-[(3-fluorophenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(4-fluorophenyl)-5-[(2-methylnaphthalen-1-yl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(4-fluorophenyl)-3-pyridin-4-yl-5-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyloxymethyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(4-fluorophenyl)-3-pyridin-4-yl-5-[[3-(trifluoromethyl)phenyl]methoxymethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 159865155
8-[4-[(3,3-difluoropyrrolidin-1-yl)methyl]phenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[4-[(3-fluoropyrrolidin-1-yl)methyl]phenyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-6-morpholin-4-yl-3-pyridinyl)imidazo[1,2-c]pyrimidin-5-amine
CID 160143057
6-[4-(3,3-Difluorocyclobutyl)oxy-2-methylphenyl]-3-(1,1-difluoroethyl)-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[5-fluoro-6-(trifluoromethyl)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[3-methyl-4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(methoxy)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(methoxy)methyl]-6-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrazine;3-methyl-6-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrazine
CID 160372174
N'-[[(5S)-3-(2-aminopyrimidin-4-yl)-2-(4-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-5-yl]methyl]-N'-[(3-methoxyphenyl)methyl]-N,N-dimethylethane-1,2-diamine;N-butyl-4-[(5S)-2-(4-fluorophenyl)-5-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]pyrimidin-2-amine;N'-[[(5S)-3-[2-(ethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-5-yl]methyl]-N'-[(3-methoxyphenyl)methyl]-N,N-dimethylethane-1,2-diamine;N'-[[(5S)-2-(4-fluorophenyl)-3-[2-(methylamino)pyrimidin-4-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-5-yl]methyl]-N'-[(3-methoxyphenyl)methyl]-N,N-dimethylethane-1,2-diamine
CID 161612034
9-fluoro-5-[2-(1-fluorocyclohexyl)ethyl]-5H-imidazo[5,1-a]isoindole;tetrakis(4-fluoro-4-[2-(9-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)ethyl]cyclohexan-1-ol);10-methoxy-7-[2-(1,4,4-trifluorocyclohexyl)ethyl]-4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaene
CID 161875060
(5S)-2-(3-bromophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(2-chlorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(3-chlorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 161893273
(7S)-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-7-[2-(trifluoromethyl)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(7R)-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-7-[2-(trifluoromethyl)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 161992820
CID 162026202
CID 162026202

Frequently Asked Questions

What is the IUPAC name of (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
The IUPAC name of (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole (CID 159914593) is (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole.
What is the SMILES notation for (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
The canonical SMILES for (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole is COc1ccc(COC[C@@H]2CCc3nc(-c4ccc(C)cc4)c(-c4ccncc4)n32)cc1.COc1ccc(COC[C@@H]2CCc3nc(-c4ccc(OC(F)(F)F)cc4)c(-c4ccncc4)n32)cc1.COc1ccc(COC[C@@H]2CCc3nc(-c4ccc5cc(OC)ccc5c4)c(-c4ccncc4)n32)cc1.COc1ccc(COC[C@@H]2CCc3nc(-c4cccc(F)c4)c(-c4ccncc4)n32)cc1.
What is the InChIKey of (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
The InChIKey is NXPSIOYVPGWXAY-BBYZOBCLSA-N. The full InChI is InChI=1S/C31H29N3O3.C27H24F3N3O3.C27H27N3O2.C26H24FN3O2/c1-35-27-9-3-21(4-10-27)19-37-20-26-8-12-29-33-30(31(34(26)29)22-13-15-32-16-14-22)25-6-5-24-18-28(36-2)11-7-23(24)17-25;1-34-22-7-2-18(3-8-22)16-35-17-21-6-11-24-32-25(26(33(21)24)20-12-14-31-15-13-20)19-4-9-23(10-5-19)36-27(28,29)30;1-19-3-7-21(8-4-19)26-27(22-13-15-28-16-14-22)30-23(9-12-25(30)29-26)18-32-17-20-5-10-24(31-2)11-6-20;1-31-23-8-5-18(6-9-23)16-32-17-22-7-10-24-29-25(20-3-2-4-21(27)15-20)26(30(22)24)19-11-13-28-14-12-19/h3-7,9-11,13-18,26H,8,12,19-20H2,1-2H3;2-5,7-10,12-15,21H,6,11,16-17H2,1H3;3-8,10-11,13-16,23H,9,12,17-18H2,1-2H3;2-6,8-9,11-15,22H,7,10,16-17H2,1H3/t26-;21-;23-;22-/m0000/s1.
What are the key properties of (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
(5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole has a molecular weight of 1842.12 g/mol, XLogP of 23.81, 30 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-2-(3-fluorophenyl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-2-(6-methoxynaphthalen-2-yl)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-2-(4-methylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole;(5S)-5-[(4-methoxyphenyl)methoxymethyl]-3-pyridin-4-yl-2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole is sourced from PubChem (CID 159914593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).