carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone

C134H151ClN19O8+ — CID 157064112

IUPACcarbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone
SMILESCc1[nH]c2cc(C(=O)N3CCCCC3)ccc2[n+]1-c1ccccc1.Cc1ccc(Cn2c(C)nc3cc(C(=O)N4CCCCC4)ccc32)cc1.Cc1cccc(-n2c(C)nc3cc(C)ccc32)c1.Cc1cccc(Cn2c(C)nc3ccc(C(=O)N4CCCCC4)cc32)c1.Cc1nc2cc(C(=O)N3CCCCC3)ccc2n1Cc1cccc(N2CCCCC2)c1.Cc1nc2cc(C(=O)N3CCN(C(=O)C4CCCCC4)CC3)ccc2n1Cc1cccc(Cl)c1.O=C=O
InChIInChI=1S/C27H31ClN4O2.C26H32N4O.2C22H25N3O.C20H21N3O.C16H16N2.CO2/c1-19-29-24-17-22(10-11-25(24)32(19)18-20-6-5-9-23(28)16-20)27(34)31-14-12-30(13-15-31)26(33)21-7-3-2-4-8-21;1-20-27-24-18-22(26(31)29-15-6-3-7-16-29)11-12-25(24)30(20)19-21-9-8-10-23(17-21)28-13-4-2-5-14-28;1-16-6-8-18(9-7-16)15-25-17(2)23-20-14-19(10-11-21(20)25)22(26)24-12-4-3-5-13-24;1-16-7-6-8-18(13-16)15-25-17(2)23-20-10-9-19(14-21(20)25)22(26)24-11-4-3-5-12-24;1-15-21-18-14-16(20(24)22-12-6-3-7-13-22)10-11-19(18)23(15)17-8-4-2-5-9-17;1-11-5-4-6-14(9-11)18-13(3)17-15-10-12(2)7-8-16(15)18;2-1-3/h5-6,9-11,16-17,21H,2-4,7-8,12-15,18H2,1H3;8-12,17-18H,2-7,13-16,19H2,1H3;6-11,14H,3-5,12-13,15H2,1-2H3;6-10,13-14H,3-5,11-12,15H2,1-2H3;2,4-5,8-11,14H,3,6-7,12-13H2,1H3;4-10H,1-3H3;/p+1
InChIKeyLVRGVCKQWWHJIC-UHFFFAOYSA-O
MW2191.26 g/mol
LogP25.32
Rot. Bonds17

About carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone

carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone (PubChem CID 157064112) has the molecular formula C134H151ClN19O8+ and a molecular weight of 2191.26 g/mol. Its IUPAC name is carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Namecarbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone
PubChem CID157064112
Molecular FormulaC134H151ClN19O8+
Molecular Weight2191.26 g/mol
Exact Mass2189.17
IUPAC Namecarbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone
SMILESCc1[nH]c2cc(C(=O)N3CCCCC3)ccc2[n+]1-c1ccccc1.Cc1ccc(Cn2c(C)nc3cc(C(=O)N4CCCCC4)ccc32)cc1.Cc1cccc(-n2c(C)nc3cc(C)ccc32)c1.Cc1cccc(Cn2c(C)nc3ccc(C(=O)N4CCCCC4)cc32)c1.Cc1nc2cc(C(=O)N3CCCCC3)ccc2n1Cc1cccc(N2CCCCC2)c1.Cc1nc2cc(C(=O)N3CCN(C(=O)C4CCCCC4)CC3)ccc2n1Cc1cccc(Cl)c1.O=C=O
InChIInChI=1S/C27H31ClN4O2.C26H32N4O.2C22H25N3O.C20H21N3O.C16H16N2.CO2/c1-19-29-24-17-22(10-11-25(24)32(19)18-20-6-5-9-23(28)16-20)27(34)31-14-12-30(13-15-31)26(33)21-7-3-2-4-8-21;1-20-27-24-18-22(26(31)29-15-6-3-7-16-29)11-12-25(24)30(20)19-21-9-8-10-23(17-21)28-13-4-2-5-14-28;1-16-6-8-18(9-7-16)15-25-17(2)23-20-14-19(10-11-21(20)25)22(26)24-12-4-3-5-13-24;1-16-7-6-8-18(13-16)15-25-17(2)23-20-10-9-19(14-21(20)25)22(26)24-11-4-3-5-12-24;1-15-21-18-14-16(20(24)22-12-6-3-7-13-22)10-11-19(18)23(15)17-8-4-2-5-9-17;1-11-5-4-6-14(9-11)18-13(3)17-15-10-12(2)7-8-16(15)18;2-1-3/h5-6,9-11,16-17,21H,2-4,7-8,12-15,18H2,1H3;8-12,17-18H,2-7,13-16,19H2,1H3;6-11,14H,3-5,12-13,15H2,1-2H3;6-10,13-14H,3-5,11-12,15H2,1-2H3;2,4-5,8-11,14H,3,6-7,12-13H2,1H3;4-10H,1-3H3;/p+1
InChIKeyLVRGVCKQWWHJIC-UHFFFAOYSA-O
XLogP25.32
TPSA268.01 Ų
H-Bond Donors1
H-Bond Acceptors19
Rotatable Bonds17
Heavy Atoms162
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002191.26
LogP ≤ 525.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone with MolForge

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Related Compounds

(5-chloro-1H-indol-2-yl)-(3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone;[4-[[4-(1,1-difluoroethyl)-3-fluorophenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[(2-fluoro-4-methylphenyl)methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone;[4-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[5-(trifluoromethyl)-1H-indol-2-yl]methanone
CID 159761873
(Z)-2-amino-1-[4-(5-chloro-1H-indole-2-carbonyl)piperazin-1-yl]-3-(3-methylphenyl)prop-2-en-1-one;(5-chloro-1H-indol-2-yl)-[4-[[4-(1,1-difluoroethyl)phenyl]methyl]piperazin-1-yl]methanone;(5-chloro-1H-indol-2-yl)-[4-(4-methylphenyl)piperazin-1-yl]methanone;(5-chloro-1H-indol-2-yl)-(4-pyridin-4-ylpiperazin-1-yl)methanone;(5-chloro-1H-indol-2-yl)-(1,3,4,5-tetrahydroindeno[1,2-c]pyridin-2-yl)methanone;[4-[(4-methylphenyl)methyl]piperazin-1-yl]-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]methanone
CID 161765716
anthracen-2-yl-(4-benzhydrylpiperazin-1-yl)methanone;1-(4-benzhydrylpiperazin-1-yl)-2-(6-chloro-1H-benzimidazol-2-yl)ethanone;(4-benzhydrylpiperazin-1-yl)-[2-(difluoromethyl)-3H-benzimidazol-5-yl]methanone;[4-(1,1-difluoroethyl)-3-fluorophenyl]-[4-[5-(trifluoromethyl)-1H-indole-2-carbonyl]piperazin-1-yl]methanone;(4-methylphenyl)-[4-[5-(trifluoromethyl)-1H-indole-2-carbonyl]piperazin-1-yl]methanone;molecular hydrogen
CID 161792585
N-(2-piperidin-1-ylethyl)-2-[4-[6-[2-[4-[2-[2-[4-[2-[[2-[4-[6-(2-piperidin-1-ylethylcarbamoyl)-1H-benzimidazol-2-yl]phenyl]-3H-benzimidazole-5-carbonyl]amino]ethyl]piperazin-1-yl]ethylcarbamoylamino]ethyl]piperazin-1-yl]ethylcarbamoyl]-1H-benzimidazol-2-yl]phenyl]-3H-benzimidazole-5-carboxamide
CID 138618261
2-[4-[6-[2-[4-[2-[[2-[methyl-[2-oxo-2-[2-[4-[2-[[2-[4-[6-(2-piperidin-1-ylethylcarbamoyl)-1H-benzimidazol-2-yl]phenyl]-3H-benzimidazole-5-carbonyl]amino]ethyl]piperazin-1-yl]ethylamino]ethyl]amino]acetyl]amino]ethyl]piperazin-1-yl]ethylcarbamoyl]-1H-benzimidazol-2-yl]phenyl]-N-(2-piperidin-1-ylethyl)-3H-benzimidazole-5-carboxamide
CID 138648948
N-[2-(dimethylamino)ethyl]-4-[6-[2-[4-[4-[3-[1-[4-[6-[2-[4-[2-(dimethylamino)ethylcarbamoyl]phenyl]-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzoyl]piperidin-4-yl]propyl]piperidine-1-carbonyl]phenyl]-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzamide
CID 138650067
N-[2-(dimethylamino)ethyl]-4-[6-[2-[4-[4-[1-[4-[6-[2-[4-[2-(dimethylamino)ethylcarbamoyl]phenyl]-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzoyl]piperidin-4-yl]piperidine-1-carbonyl]phenyl]-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzamide
CID 138650081
2-[4-(2-adamantylcarbamoyl)phenyl]-N-(4-fluorophenyl)-3H-benzimidazole-5-carboxamide;2-[4-(2-bicyclo[2.2.1]heptanylcarbamoyl)phenyl]-N-(4-fluorophenyl)-3H-benzimidazole-5-carboxamide;2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-N-(4-fluorophenyl)-3H-benzimidazole-5-carboxamide;N-(4-fluorophenyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-(4-fluorophenyl)-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide
CID 157077285
CID 157093604
CID 157093604
2-anilino-N,N-bis(3-methylbutyl)-3-(3-piperidin-1-ylpropyl)benzimidazole-5-carboxamide;bis(2-anilino-N,N-dibutyl-3-(3-piperidin-1-ylpropyl)benzimidazole-5-carboxamide);2-(benzylamino)-N,N-bis(3-methylbutyl)-3-(3-piperidin-1-ylpropyl)benzimidazole-5-carboxamide
CID 157102771
(E)-N-[3-[(3R)-3-[[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]amino]piperidine-1-carbonyl]phenyl]-4-(dimethylamino)but-2-enamide;(E)-N-[3-[3-[[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]amino]piperidine-1-carbonyl]phenyl]-4-(dimethylamino)but-2-enamide;(E)-N-[4-[3-[[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]methyl]piperidine-1-carbonyl]-2-methylphenyl]-4-(dimethylamino)but-2-enamide;(E)-N-[4-[3-[[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]methyl]piperidine-1-carbonyl]-3-methylphenyl]-4-(dimethylamino)but-2-enamide
CID 157113207
4-(6-acetyl-1H-benzimidazol-2-yl)-N-cyclohexylbenzamide;2-[4-(1-adamantylcarbamoyl)phenyl]-N-pyridin-3-yl-3H-benzimidazole-5-carboxamide;2-[4-(2-adamantylcarbamoyl)phenyl]-N-pyridin-3-yl-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-pyridin-3-yl-3H-benzimidazole-5-carboxamide;pyridin-3-amine
CID 157130647

Frequently Asked Questions

What is the IUPAC name of carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone?
The IUPAC name of carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone (CID 157064112) is carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone.
What is the SMILES notation for carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone?
The canonical SMILES for carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone is Cc1[nH]c2cc(C(=O)N3CCCCC3)ccc2[n+]1-c1ccccc1.Cc1ccc(Cn2c(C)nc3cc(C(=O)N4CCCCC4)ccc32)cc1.Cc1cccc(-n2c(C)nc3cc(C)ccc32)c1.Cc1cccc(Cn2c(C)nc3ccc(C(=O)N4CCCCC4)cc32)c1.Cc1nc2cc(C(=O)N3CCCCC3)ccc2n1Cc1cccc(N2CCCCC2)c1.Cc1nc2cc(C(=O)N3CCN(C(=O)C4CCCCC4)CC3)ccc2n1Cc1cccc(Cl)c1.O=C=O.
What is the InChIKey of carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone?
The InChIKey is LVRGVCKQWWHJIC-UHFFFAOYSA-O. The full InChI is InChI=1S/C27H31ClN4O2.C26H32N4O.2C22H25N3O.C20H21N3O.C16H16N2.CO2/c1-19-29-24-17-22(10-11-25(24)32(19)18-20-6-5-9-23(28)16-20)27(34)31-14-12-30(13-15-31)26(33)21-7-3-2-4-8-21;1-20-27-24-18-22(26(31)29-15-6-3-7-16-29)11-12-25(24)30(20)19-21-9-8-10-23(17-21)28-13-4-2-5-14-28;1-16-6-8-18(9-7-16)15-25-17(2)23-20-14-19(10-11-21(20)25)22(26)24-12-4-3-5-13-24;1-16-7-6-8-18(13-16)15-25-17(2)23-20-10-9-19(14-21(20)25)22(26)24-11-4-3-5-12-24;1-15-21-18-14-16(20(24)22-12-6-3-7-13-22)10-11-19(18)23(15)17-8-4-2-5-9-17;1-11-5-4-6-14(9-11)18-13(3)17-15-10-12(2)7-8-16(15)18;2-1-3/h5-6,9-11,16-17,21H,2-4,7-8,12-15,18H2,1H3;8-12,17-18H,2-7,13-16,19H2,1H3;6-11,14H,3-5,12-13,15H2,1-2H3;6-10,13-14H,3-5,11-12,15H2,1-2H3;2,4-5,8-11,14H,3,6-7,12-13H2,1H3;4-10H,1-3H3;/p+1.
What are the key properties of carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone?
carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone has a molecular weight of 2191.26 g/mol, XLogP of 25.32, 17 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 157064112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).