2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole

C80H86Cl4N20O2 — CID 162191084

IUPAC2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole
SMILESC=C(C)N1[C@@H]2C[C@H]1CN(c1cc(-c3nc4ccccc4n3C)c(Cl)cn1)C2.CC(=O)N(C)C1CCN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)C1.CC(C)NC(=O)NC1CN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)C1.Cn1c(-c2cc(N3CC4CC(C4)C3)ncc2Cl)nc2ccccc21
InChIInChI=1S/C21H22ClN5.C20H23ClN6O.C20H22ClN5O.C19H19ClN4/c1-13(2)27-14-8-15(27)12-26(11-14)20-9-16(17(22)10-23-20)21-24-18-6-4-5-7-19(18)25(21)3;1-12(2)23-20(28)24-13-10-27(11-13)18-8-14(15(21)9-22-18)19-25-16-6-4-5-7-17(16)26(19)3;1-13(27)24(2)14-8-9-26(12-14)19-10-15(16(21)11-22-19)20-23-17-6-4-5-7-18(17)25(20)3;1-23-17-5-3-2-4-16(17)22-19(23)14-8-18(21-9-15(14)20)24-10-12-6-13(7-12)11-24/h4-7,9-10,14-15H,1,8,11-12H2,2-3H3;4-9,12-13H,10-11H2,1-3H3,(H2,23,24,28);4-7,10-11,14H,8-9,12H2,1-3H3;2-5,8-9,12-13H,6-7,10-11H2,1H3/t14-,15+;;;
InChIKeyZQHQGPUXEGUYJO-GOPUQGNXSA-N
MW1501.52 g/mol
LogP14.75
Rot. Bonds12

About 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole

2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole (PubChem CID 162191084) has the molecular formula C80H86Cl4N20O2 and a molecular weight of 1501.52 g/mol. Its IUPAC name is 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole.

Molecular Properties

Compound Name2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole
PubChem CID162191084
Molecular FormulaC80H86Cl4N20O2
Molecular Weight1501.52 g/mol
Exact Mass1498.60
IUPAC Name2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole
SMILESC=C(C)N1[C@@H]2C[C@H]1CN(c1cc(-c3nc4ccccc4n3C)c(Cl)cn1)C2.CC(=O)N(C)C1CCN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)C1.CC(C)NC(=O)NC1CN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)C1.Cn1c(-c2cc(N3CC4CC(C4)C3)ncc2Cl)nc2ccccc21
InChIInChI=1S/C21H22ClN5.C20H23ClN6O.C20H22ClN5O.C19H19ClN4/c1-13(2)27-14-8-15(27)12-26(11-14)20-9-16(17(22)10-23-20)21-24-18-6-4-5-7-19(18)25(21)3;1-12(2)23-20(28)24-13-10-27(11-13)18-8-14(15(21)9-22-18)19-25-16-6-4-5-7-17(16)26(19)3;1-13(27)24(2)14-8-9-26(12-14)19-10-15(16(21)11-22-19)20-23-17-6-4-5-7-18(17)25(20)3;1-23-17-5-3-2-4-16(17)22-19(23)14-8-18(21-9-15(14)20)24-10-12-6-13(7-12)11-24/h4-7,9-10,14-15H,1,8,11-12H2,2-3H3;4-9,12-13H,10-11H2,1-3H3,(H2,23,24,28);4-7,10-11,14H,8-9,12H2,1-3H3;2-5,8-9,12-13H,6-7,10-11H2,1H3/t14-,15+;;;
InChIKeyZQHQGPUXEGUYJO-GOPUQGNXSA-N
XLogP14.75
TPSA200.48 Ų
H-Bond Donors2
H-Bond Acceptors19
Rotatable Bonds12
Heavy Atoms106
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001501.52
LogP ≤ 514.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1019

Analyze 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;bis(1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one);1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one
CID 157959708
4-(6-chloro-2-methylbenzimidazol-1-yl)-2-[4-(trifluoromethyl)anilino]-1H-pyrimidin-6-one;6-(5-chloro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-(6-chloro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-(2-ethyl-5-fluorobenzimidazol-1-yl)-2-N-[6-(trifluoromethyl)-3-pyridinyl]pyrimidine-2,4-diamine;6-(2-ethyl-6-fluorobenzimidazol-1-yl)-2-N-[6-(trifluoromethyl)-3-pyridinyl]pyrimidine-2,4-diamine;6-(6-fluoro-2-methylimidazo[1,2-a]pyrimidin-3-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 158125607
(5S)-1-[2-[[(1S)-1-[1-(4-chlorophenyl)imidazol-4-yl]ethyl]amino]pyrimidin-4-yl]-4,4-dideuterio-5-propan-2-yl-3-(trideuteriomethyl)imidazolidin-2-one;(4S,5S)-1-[2-[[(1S)-1-[1-(4-chlorophenyl)imidazol-4-yl]ethyl]amino]pyrimidin-4-yl]-3,4-dimethyl-5-propan-2-ylimidazolidin-2-one;(4R,5S)-1-[2-[[(1S)-1-[1-(4-chlorophenyl)imidazol-4-yl]ethyl]amino]pyrimidin-4-yl]-3,4-dimethyl-5-propan-2-ylimidazolidin-2-one;(4R,5S)-4-methyl-5-propan-2-yl-1-[2-[[(1S)-1-[1-[4-(trifluoromethyl)phenyl]imidazol-4-yl]ethyl]amino]pyrimidin-4-yl]imidazolidin-2-one
CID 159680699
6-(6-chloro-2-ethylimidazo[4,5-b]pyridin-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;4-chloro-6-(2-methylbenzimidazol-1-yl)-N-[6-(trifluoromethyl)-3-pyridinyl]pyrimidin-2-amine;6-(6-chloro-2-methylimidazo[4,5-b]pyridin-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-(4,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-[2-(difluoromethyl)-6-fluorobenzimidazol-1-yl]-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-(4-fluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 160544143
5-Chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine
CID 161078862
2-(benzimidazol-1-yl)-7-[(5S)-5-[2-(benzimidazol-1-yl)-7-[6-[[2-(benzimidazol-1-yl)-8-oxo-7H-purin-9-yl]methyl]-2-pyridinyl]-8-oxopurin-9-yl]-5,6,7,8-tetrahydroquinolin-8-yl]-9-[(6-chloro-3-pyridinyl)methyl]purin-8-one
CID 143306741
N-(4-chlorophenyl)-5-[1-(cyclopropylmethyl)imidazol-2-yl]pyridin-2-amine;N-(4-chlorophenyl)-5-(1-ethylimidazol-2-yl)pyridin-2-amine;N-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyridin-2-amine;N-(4-chlorophenyl)-5-[1-(2-methylpropyl)imidazol-2-yl]pyridin-2-amine;N-(4-chlorophenyl)-5-(1-propan-2-ylimidazol-2-yl)pyridin-2-amine;N-(4-chlorophenyl)-5-(1-propylimidazol-2-yl)pyridin-2-amine
CID 157069592
(2R)-N-(6-tert-butyl-1H-benzimidazol-2-yl)-4-(3-chloro-2-pyridinyl)-2-methylpiperazine-1-carboxamide;N-(6-tert-butyl-1-methylbenzimidazol-2-yl)-4-(3-chloro-2-pyridinyl)piperazine-1-carboxamide;(2S)-4-(3-chloro-2-pyridinyl)-N-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-methylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-[1-methyl-5-(2-methylpropyl)benzimidazol-2-yl]piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(1,5,6-trimethylbenzimidazol-2-yl)piperazine-1-carboxamide
CID 157075838
3-(aminomethyl)aniline;N-[3-(aminomethyl)phenyl]-2-[[4-(dimethylamino)cyclohexyl]methyl]-9-propan-2-ylpurin-6-amine;tert-butyl N-[(3-aminophenyl)methyl]carbamate;tert-butyl N-[[3-[(2-chloro-9-propan-2-ylpurin-6-yl)amino]phenyl]methyl]carbamate;tert-butyl N-[[3-[[2-[[4-(dimethylamino)cyclohexyl]methyl]-9-propan-2-ylpurin-6-yl]amino]phenyl]methyl]carbamate;2,6-dichloro-9-propan-2-ylpurine;2,4-dichloro-7H-pyrrolo[3,2-d]pyrimidine;N-[[3-[[2-[[4-(dimethylamino)cyclohexyl]methyl]-9-propan-2-ylpurin-6-yl]amino]phenyl]methyl]prop-2-enamide;4-N,4-N-dimethylcyclohexane-1,4-diamine;prop-2-enoyl chloride
CID 157243801
2-(8-chloro-2-methylimidazo[1,2-a]pyridin-6-yl)-7-(4-propan-2-ylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-4-one;2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-7-(4-propan-2-ylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1,2,3,6-tetrahydropyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-7-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1,2,3,6-tetrahydropyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one
CID 157279929
(5S)-1-[2-[[(1S)-1-[1-(4-chlorophenyl)imidazol-4-yl]ethyl]amino]pyrimidin-4-yl]-4,4-dideuterio-3-methyl-5-propan-2-ylimidazolidin-2-one;(4S,5S)-1-[2-[[(1S)-1-[1-(4-chlorophenyl)imidazol-4-yl]ethyl]amino]pyrimidin-4-yl]-4-methyl-5-propan-2-ylimidazolidin-2-one;(4R,5S)-1-[2-[[(1S)-1-[1-(4-chlorophenyl)imidazol-4-yl]ethyl]amino]pyrimidin-4-yl]-4-methyl-5-propan-2-ylimidazolidin-2-one;(5S)-1-[2-[[(1S)-1-[1-(4-methylphenyl)imidazol-4-yl]ethyl]amino]pyrimidin-4-yl]-5-propan-2-ylimidazolidin-2-one
CID 157435752
2-(8-Chloro-2-methylimidazo[1,2-a]pyridin-6-yl)-7-(4-propan-2-ylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-4-one;2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-7-(4-propan-2-ylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1,2,3,6-tetrahydropyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1,2,3,6-tetrahydropyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one
CID 157470982

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole?
The IUPAC name of 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole (CID 162191084) is 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole.
What is the SMILES notation for 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole?
The canonical SMILES for 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole is C=C(C)N1[C@@H]2C[C@H]1CN(c1cc(-c3nc4ccccc4n3C)c(Cl)cn1)C2.CC(=O)N(C)C1CCN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)C1.CC(C)NC(=O)NC1CN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)C1.Cn1c(-c2cc(N3CC4CC(C4)C3)ncc2Cl)nc2ccccc21.
What is the InChIKey of 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole?
The InChIKey is ZQHQGPUXEGUYJO-GOPUQGNXSA-N. The full InChI is InChI=1S/C21H22ClN5.C20H23ClN6O.C20H22ClN5O.C19H19ClN4/c1-13(2)27-14-8-15(27)12-26(11-14)20-9-16(17(22)10-23-20)21-24-18-6-4-5-7-19(18)25(21)3;1-12(2)23-20(28)24-13-10-27(11-13)18-8-14(15(21)9-22-18)19-25-16-6-4-5-7-17(16)26(19)3;1-13(27)24(2)14-8-9-26(12-14)19-10-15(16(21)11-22-19)20-23-17-6-4-5-7-18(17)25(20)3;1-23-17-5-3-2-4-16(17)22-19(23)14-8-18(21-9-15(14)20)24-10-12-6-13(7-12)11-24/h4-7,9-10,14-15H,1,8,11-12H2,2-3H3;4-9,12-13H,10-11H2,1-3H3,(H2,23,24,28);4-7,10-11,14H,8-9,12H2,1-3H3;2-5,8-9,12-13H,6-7,10-11H2,1H3/t14-,15+;;;.
What are the key properties of 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole?
2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole has a molecular weight of 1501.52 g/mol, XLogP of 14.75, 12 rotatable bonds, 2 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-azabicyclo[3.1.1]heptan-3-yl)-5-chloro-4-pyridinyl]-1-methylbenzimidazole;1-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]-3-propan-2-ylurea;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]-N-methylacetamide;2-[5-chloro-2-[(1S,5R)-6-prop-1-en-2-yl-3,6-diazabicyclo[3.1.1]heptan-3-yl]-4-pyridinyl]-1-methylbenzimidazole is sourced from PubChem (CID 162191084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).