carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline

C105H92Cl5F4N19O10 — CID 160977941

IUPACcarbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline
SMILESC/C=C(\CC)C(=O)OCC.CCOC(=O)c1cnc2ccc(-n3cnc(C)c3)cc2c1Cl.CCOC(=O)c1cnc2ccc(-n3cnc(C)c3)cc2c1Nc1ccc(F)c(Cl)c1.Cc1cn(-c2ccc(N)cc2)cn1.Cc1cn(-c2ccc3ncc(CO)c(Nc4ccc(F)c(Cl)c4)c3c2)cn1.Cc1cn(-c2ccc3ncc4ccc(=O)n(-c5ccc(F)c(Cl)c5)c4c3c2)cn1.Nc1ccc(F)c(Cl)c1.O=C=O
InChIInChI=1S/C22H18ClFN4O2.C22H14ClFN4O.C20H16ClFN4O.C16H14ClN3O2.C10H11N3.C8H14O2.C6H5ClFN.CO2/c1-3-30-22(29)17-10-25-20-7-5-15(28-11-13(2)26-12-28)9-16(20)21(17)27-14-4-6-19(24)18(23)8-14;1-13-11-27(12-26-13)15-4-6-20-17(8-15)22-14(10-25-20)2-7-21(29)28(22)16-3-5-19(24)18(23)9-16;1-12-9-26(11-24-12)15-3-5-19-16(7-15)20(13(10-27)8-23-19)25-14-2-4-18(22)17(21)6-14;1-3-22-16(21)13-7-18-14-5-4-11(6-12(14)15(13)17)20-8-10(2)19-9-20;1-8-6-13(7-12-8)10-4-2-9(11)3-5-10;1-4-7(5-2)8(9)10-6-3;7-5-3-4(9)1-2-6(5)8;2-1-3/h4-12H,3H2,1-2H3,(H,25,27);2-12H,1H3;2-9,11,27H,10H2,1H3,(H,23,25);4-9H,3H2,1-2H3;2-7H,11H2,1H3;4H,5-6H2,1-3H3;1-3H,9H2;/b;;;;;7-4+;;
InChIKeySZCVHFKIZVAPRC-BFBOXKQKSA-N
MW2033.27 g/mol
LogP23.73
Rot. Bonds18

About carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline

carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline (PubChem CID 160977941) has the molecular formula C105H92Cl5F4N19O10 and a molecular weight of 2033.27 g/mol. Its IUPAC name is carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline.

Molecular Properties

Compound Namecarbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline
PubChem CID160977941
Molecular FormulaC105H92Cl5F4N19O10
Molecular Weight2033.27 g/mol
Exact Mass2029.57
IUPAC Namecarbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline
SMILESC/C=C(\CC)C(=O)OCC.CCOC(=O)c1cnc2ccc(-n3cnc(C)c3)cc2c1Cl.CCOC(=O)c1cnc2ccc(-n3cnc(C)c3)cc2c1Nc1ccc(F)c(Cl)c1.Cc1cn(-c2ccc(N)cc2)cn1.Cc1cn(-c2ccc3ncc(CO)c(Nc4ccc(F)c(Cl)c4)c3c2)cn1.Cc1cn(-c2ccc3ncc4ccc(=O)n(-c5ccc(F)c(Cl)c5)c4c3c2)cn1.Nc1ccc(F)c(Cl)c1.O=C=O
InChIInChI=1S/C22H18ClFN4O2.C22H14ClFN4O.C20H16ClFN4O.C16H14ClN3O2.C10H11N3.C8H14O2.C6H5ClFN.CO2/c1-3-30-22(29)17-10-25-20-7-5-15(28-11-13(2)26-12-28)9-16(20)21(17)27-14-4-6-19(24)18(23)8-14;1-13-11-27(12-26-13)15-4-6-20-17(8-15)22-14(10-25-20)2-7-21(29)28(22)16-3-5-19(24)18(23)9-16;1-12-9-26(11-24-12)15-3-5-19-16(7-15)20(13(10-27)8-23-19)25-14-2-4-18(22)17(21)6-14;1-3-22-16(21)13-7-18-14-5-4-11(6-12(14)15(13)17)20-8-10(2)19-9-20;1-8-6-13(7-12-8)10-4-2-9(11)3-5-10;1-4-7(5-2)8(9)10-6-3;7-5-3-4(9)1-2-6(5)8;2-1-3/h4-12H,3H2,1-2H3,(H,25,27);2-12H,1H3;2-9,11,27H,10H2,1H3,(H,23,25);4-9H,3H2,1-2H3;2-7H,11H2,1H3;4H,5-6H2,1-3H3;1-3H,9H2;/b;;;;;7-4+;;
InChIKeySZCVHFKIZVAPRC-BFBOXKQKSA-N
XLogP23.73
TPSA372.03 Ų
H-Bond Donors5
H-Bond Acceptors29
Rotatable Bonds18
Heavy Atoms143
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002033.27
LogP ≤ 523.73
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline with MolForge

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Related Compounds

1-[1-(4-Chlorophenyl)-2-methylindol-3-yl]-2-[4-hydroxy-4-(trifluoromethyl)piperidin-1-yl]ethanone;1-[1-(3,4-difluorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;3-hydroxy-3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-6-yl]propanamide;1-[6-imidazol-1-yl-1-(4-isocyanophenyl)-2-methylpyrrolo[3,2-b]pyridin-3-yl]-2-piperidin-1-ylethanone
CID 167710371
Tert-butyl 3-aminopyrrolidine-1-carboxylate;7-chloro-3-(2,6-difluorophenyl)-1-(1-methylpyrrolidin-3-yl)-1,6-naphthyridin-2-one;6-chloro-4-[(1-methylpyrrolidin-3-yl)amino]pyridine-3-carbaldehyde;[6-chloro-4-[(1-methylpyrrolidin-3-yl)amino]-3-pyridinyl]methanol;3-(2,6-difluorophenyl)-7-[(5-fluoro-2-pyridinyl)amino]-1-(1-methylpyrrolidin-3-yl)-1,6-naphthyridin-2-one;1-(2,6-difluorophenyl)propan-2-one;dioxomanganese;ethyl 6-chloro-4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]amino]pyridine-3-carboxylate;ethyl 4,6-dichloropyridine-3-carboxylate;5-fluoropyridin-2-amine;methane
CID 158836912
potassium;azane;2-chloro-8-(1-methylimidazol-4-yl)-3H-pyrido[3,4-d]pyrimidin-4-one;2,4-dichloro-8-(1-methylimidazol-4-yl)pyrido[3,4-d]pyrimidine;hydride;methane;methanol;2-methoxy-8-(1-methylimidazol-4-yl)-3H-pyrido[3,4-d]pyrimidin-4-one;methyl 3-amino-2-chloropyridine-4-carboxylate;methyl 3-amino-2-(1-methylimidazol-4-yl)pyridine-4-carboxylate;methyl 3-aminopyridine-4-carboxylate;8-(1-methylimidazol-4-yl)-1H-1,7-naphthyridine-2,4-dione;molecular hydrogen;phosphane;tributyl-(1-methylimidazol-4-yl)stannane
CID 159161731
4-aminocyclohexan-1-ol;6-chloro-4-[(4-hydroxycyclohexyl)amino]-1,5-naphthyridine-3-carboxylic acid;8-chloro-1-(4-hydroxycyclohexyl)-3H-imidazo[4,5-c][1,5]naphthyridin-2-one;8-chloro-1-(4-hydroxycyclohexyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one;8-[6-(dimethylamino)-3-pyridinyl]-1-(4-hydroxycyclohexyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one;ethyl 4,6-dichloro-1,5-naphthyridine-3-carboxylate;methane
CID 159730189
7-chloro-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indole-2-carboxylic acid;methyl 7-chloro-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indole-2-carboxylate;5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indole-2-carboxylic acid;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indole-2-carboxylic acid
CID 159847358
2-[3-acetyl-5-(pyrimidin-5-ylamino)indol-1-yl]acetic acid;(2S,4R)-1-[2-[3-acetyl-5-(pyrimidin-5-ylamino)indol-1-yl]acetyl]-N-[(1R)-1-(3-chloro-2-fluorophenyl)-2-hydroxyethyl]-4-fluoropyrrolidine-2-carboxamide;(2R)-2-amino-2-(3-chloro-2-fluorophenyl)ethanol;tert-butyl (2S,4R)-2-[[(1R)-1-(3-chloro-2-fluorophenyl)-2-hydroxyethyl]carbamoyl]-4-fluoropyrrolidine-1-carboxylate;bis((2S,4R)-N-[(1R)-1-(3-chloro-2-fluorophenyl)-2-hydroxyethyl]-4-fluoropyrrolidine-2-carboxamide);(2S,4R)-4-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;dihydrochloride
CID 160320736
3-acetyl-1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]-N-phenylindole-5-carboxamide;3-acetyl-1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]-N-pyrimidin-5-ylindole-5-carboxamide;2-(3-acetylindol-1-yl)-N-[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-N-propan-2-ylacetamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]-5-(pyrimidin-5-ylmethyl)indole-3-carboxamide;methyl 3-acetyl-1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]indole-5-carboxylate
CID 160560343
4-Amino-3-ethylbenzoic acid;6-chloro-1-methylimidazo[4,5-c]pyridine;[3-ethyl-4-[methyl-(1-methylimidazo[4,5-c]pyridin-6-yl)amino]phenyl]methanol;methyl 4-amino-3-ethylbenzoate;methyl 3-ethyl-4-[(1-methylimidazo[4,5-c]pyridin-6-yl)amino]benzoate;methyl 3-ethyl-4-[methyl-(1-methylimidazo[4,5-c]pyridin-6-yl)amino]benzoate
CID 161783335
lithium;(6-amino-3-pyridinyl)boronic acid;6-(2-chloro-5-fluoropyrimidin-4-yl)-4-fluoro-2-methyl-1-propan-2-ylbenzimidazole;deuterioethane;6-[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-N-hydroxypyridine-3-carboxamide;6-[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-N-(oxan-2-yloxy)pyridine-3-carboxamide;6-[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]pyridine-3-carboxylic acid;methane;methyl 6-(6-amino-3-pyridinyl)pyridine-3-carboxylate;methyl 6-chloropyridine-3-carboxylate;methyl 6-[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]pyridine-3-carboxylate;O-(oxan-2-yl)hydroxylamine;hydroxide;hydrate;hydrochloride
CID 163416088

Frequently Asked Questions

What is the IUPAC name of carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline?
The IUPAC name of carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline (CID 160977941) is carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline.
What is the SMILES notation for carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline?
The canonical SMILES for carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline is C/C=C(\CC)C(=O)OCC.CCOC(=O)c1cnc2ccc(-n3cnc(C)c3)cc2c1Cl.CCOC(=O)c1cnc2ccc(-n3cnc(C)c3)cc2c1Nc1ccc(F)c(Cl)c1.Cc1cn(-c2ccc(N)cc2)cn1.Cc1cn(-c2ccc3ncc(CO)c(Nc4ccc(F)c(Cl)c4)c3c2)cn1.Cc1cn(-c2ccc3ncc4ccc(=O)n(-c5ccc(F)c(Cl)c5)c4c3c2)cn1.Nc1ccc(F)c(Cl)c1.O=C=O.
What is the InChIKey of carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline?
The InChIKey is SZCVHFKIZVAPRC-BFBOXKQKSA-N. The full InChI is InChI=1S/C22H18ClFN4O2.C22H14ClFN4O.C20H16ClFN4O.C16H14ClN3O2.C10H11N3.C8H14O2.C6H5ClFN.CO2/c1-3-30-22(29)17-10-25-20-7-5-15(28-11-13(2)26-12-28)9-16(20)21(17)27-14-4-6-19(24)18(23)8-14;1-13-11-27(12-26-13)15-4-6-20-17(8-15)22-14(10-25-20)2-7-21(29)28(22)16-3-5-19(24)18(23)9-16;1-12-9-26(11-24-12)15-3-5-19-16(7-15)20(13(10-27)8-23-19)25-14-2-4-18(22)17(21)6-14;1-3-22-16(21)13-7-18-14-5-4-11(6-12(14)15(13)17)20-8-10(2)19-9-20;1-8-6-13(7-12-8)10-4-2-9(11)3-5-10;1-4-7(5-2)8(9)10-6-3;7-5-3-4(9)1-2-6(5)8;2-1-3/h4-12H,3H2,1-2H3,(H,25,27);2-12H,1H3;2-9,11,27H,10H2,1H3,(H,23,25);4-9H,3H2,1-2H3;2-7H,11H2,1H3;4H,5-6H2,1-3H3;1-3H,9H2;/b;;;;;7-4+;;.
What are the key properties of carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline?
carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline has a molecular weight of 2033.27 g/mol, XLogP of 23.73, 18 rotatable bonds, 5 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for carbon dioxide;3-chloro-4-fluoroaniline;[4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinolin-3-yl]methanol;1-(3-chloro-4-fluorophenyl)-9-(4-methylimidazol-1-yl)benzo[h][1,6]naphthyridin-2-one;ethyl 4-(3-chloro-4-fluoroanilino)-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl 4-chloro-6-(4-methylimidazol-1-yl)quinoline-3-carboxylate;ethyl (E)-2-ethylbut-2-enoate;4-(4-methylimidazol-1-yl)aniline is sourced from PubChem (CID 160977941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).