4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate

C118H98ClF10N21O13 — CID 160856442

IUPAC4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate
SMILESCCOC(=O)c1cn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)nc1C(F)(F)F.CCOC(=O)c1cnn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)c1.CC[C@](O)(c1cn(Cc2ccc3c(-c4ccc(Cl)cc4)cc(C(N)=O)nc3c2)nn1)C(F)(F)F.COC(=O)c1cnn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)c1.NC(=O)c1cc(-c2ccc(F)cc2)c2ccc(Cn3cc(C(O)C4CCCC4)cn3)cc2n1
InChIInChI=1S/C26H25FN4O2.C24H18F4N4O3.C23H19ClF3N5O2.C23H19FN4O3.C22H17FN4O3/c27-20-8-6-17(7-9-20)22-12-24(26(28)33)30-23-11-16(5-10-21(22)23)14-31-15-19(13-29-31)25(32)18-3-1-2-4-18;1-2-35-23(34)18-12-32(31-21(18)24(26,27)28)11-13-3-8-16-17(14-4-6-15(25)7-5-14)10-20(22(29)33)30-19(16)9-13;1-2-22(34,23(25,26)27)20-12-32(31-30-20)11-13-3-8-16-17(14-4-6-15(24)7-5-14)10-19(21(28)33)29-18(16)9-13;1-2-31-23(30)16-11-26-28(13-16)12-14-3-8-18-19(15-4-6-17(24)7-5-15)10-21(22(25)29)27-20(18)9-14;1-30-22(29)15-10-25-27(12-15)11-13-2-7-17-18(14-3-5-16(23)6-4-14)9-20(21(24)28)26-19(17)8-13/h5-13,15,18,25,32H,1-4,14H2,(H2,28,33);3-10,12H,2,11H2,1H3,(H2,29,33);3-10,12,34H,2,11H2,1H3,(H2,28,33);3-11,13H,2,12H2,1H3,(H2,25,29);2-10,12H,11H2,1H3,(H2,24,28)/t;;22-;;/m..0../s1
InChIKeySJXPAUDQRVZTCW-OGQOLJBHSA-N
MW2243.65 g/mol
LogP20.37
Rot. Bonds29

About 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate

4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate (PubChem CID 160856442) has the molecular formula C118H98ClF10N21O13 and a molecular weight of 2243.65 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate.

Molecular Properties

Compound Name4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate
PubChem CID160856442
Molecular FormulaC118H98ClF10N21O13
Molecular Weight2243.65 g/mol
Exact Mass2241.72
IUPAC Name4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate
SMILESCCOC(=O)c1cn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)nc1C(F)(F)F.CCOC(=O)c1cnn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)c1.CC[C@](O)(c1cn(Cc2ccc3c(-c4ccc(Cl)cc4)cc(C(N)=O)nc3c2)nn1)C(F)(F)F.COC(=O)c1cnn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)c1.NC(=O)c1cc(-c2ccc(F)cc2)c2ccc(Cn3cc(C(O)C4CCCC4)cn3)cc2n1
InChIInChI=1S/C26H25FN4O2.C24H18F4N4O3.C23H19ClF3N5O2.C23H19FN4O3.C22H17FN4O3/c27-20-8-6-17(7-9-20)22-12-24(26(28)33)30-23-11-16(5-10-21(22)23)14-31-15-19(13-29-31)25(32)18-3-1-2-4-18;1-2-35-23(34)18-12-32(31-21(18)24(26,27)28)11-13-3-8-16-17(14-4-6-15(25)7-5-14)10-20(22(29)33)30-19(16)9-13;1-2-22(34,23(25,26)27)20-12-32(31-30-20)11-13-3-8-16-17(14-4-6-15(24)7-5-14)10-19(21(28)33)29-18(16)9-13;1-2-31-23(30)16-11-26-28(13-16)12-14-3-8-18-19(15-4-6-17(24)7-5-15)10-21(22(25)29)27-20(18)9-14;1-30-22(29)15-10-25-27(12-15)11-13-2-7-17-18(14-3-5-16(23)6-4-14)9-20(21(24)28)26-19(17)8-13/h5-13,15,18,25,32H,1-4,14H2,(H2,28,33);3-10,12H,2,11H2,1H3,(H2,29,33);3-10,12,34H,2,11H2,1H3,(H2,28,33);3-11,13H,2,12H2,1H3,(H2,25,29);2-10,12H,11H2,1H3,(H2,24,28)/t;;22-;;/m..0../s1
InChIKeySJXPAUDQRVZTCW-OGQOLJBHSA-N
XLogP20.37
TPSA501.25 Ų
H-Bond Donors7
H-Bond Acceptors29
Rotatable Bonds29
Heavy Atoms163
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002243.65
LogP ≤ 520.37
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Analyze 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate with MolForge

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Related Compounds

Lithium;1-[(3-chloroquinolin-6-yl)methyl]-5-methyltriazole-4-carboxylic acid;3-[(3-chloroquinolin-6-yl)methyl]-5-methyltriazole-4-carboxylic acid;2-[(3-chloroquinolin-6-yl)methyl]-5-(trifluoromethyl)triazole-4-carboxylic acid;ethyl 1-[(3-chloroquinolin-6-yl)methyl]-5-methyltriazole-4-carboxylate;ethyl 3-[(3-chloroquinolin-6-yl)methyl]-5-methyltriazole-4-carboxylate;ethyl 2-[(3-chloroquinolin-6-yl)methyl]-5-(trifluoromethyl)triazole-4-carboxylate;hydroxide
CID 157219637
7-[(4-bromoimidazol-1-yl)methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;4-(2-fluorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;4-(2-fluoro-3-pyridinyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate
CID 157657845
7-[[4-[Cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate
CID 160136486
ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;4-(5-fluoro-2-pyridinyl)-7-[[4-[(2R)-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;4-(6-fluoro-3-pyridinyl)-7-[[4-[(2R)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[(2R)-2-hydroxybutan-2-yl]triazol-1-yl]methyl]-4-(2-methylphenyl)quinoline-2-carboxamide
CID 162016974
7-[(4-Bromoimidazol-1-yl)methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;4-(4-fluorophenyl)-7-(imidazol-1-ylmethyl)quinoline-2-carboxamide;4-(4-fluorophenyl)-7-[(2-propan-2-ylimidazol-1-yl)methyl]quinoline-2-carboxamide;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate
CID 159061824
8-fluoro-7-[[(2S)-2-methylmorpholin-4-yl]methyl]-4-(1-methylpyrazol-4-yl)quinoline-2-carboxamide;8-fluoro-7-[[(2R)-2-methylmorpholin-4-yl]methyl]-4-(1-methylpyrazol-4-yl)quinoline-2-carboxamide;methanol;methyl 8-fluoro-7-[[(2S)-2-methylmorpholin-4-yl]methyl]-4-(1-methylpyrazol-4-yl)quinoline-2-carboxylate;methyl 8-fluoro-7-[[(2R)-2-methylmorpholin-4-yl]methyl]-4-(1-methylpyrazol-4-yl)quinoline-2-carboxylate
CID 159502530

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate?
The IUPAC name of 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate (CID 160856442) is 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate.
What is the SMILES notation for 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate?
The canonical SMILES for 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate is CCOC(=O)c1cn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)nc1C(F)(F)F.CCOC(=O)c1cnn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)c1.CC[C@](O)(c1cn(Cc2ccc3c(-c4ccc(Cl)cc4)cc(C(N)=O)nc3c2)nn1)C(F)(F)F.COC(=O)c1cnn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)c1.NC(=O)c1cc(-c2ccc(F)cc2)c2ccc(Cn3cc(C(O)C4CCCC4)cn3)cc2n1.
What is the InChIKey of 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate?
The InChIKey is SJXPAUDQRVZTCW-OGQOLJBHSA-N. The full InChI is InChI=1S/C26H25FN4O2.C24H18F4N4O3.C23H19ClF3N5O2.C23H19FN4O3.C22H17FN4O3/c27-20-8-6-17(7-9-20)22-12-24(26(28)33)30-23-11-16(5-10-21(22)23)14-31-15-19(13-29-31)25(32)18-3-1-2-4-18;1-2-35-23(34)18-12-32(31-21(18)24(26,27)28)11-13-3-8-16-17(14-4-6-15(25)7-5-14)10-20(22(29)33)30-19(16)9-13;1-2-22(34,23(25,26)27)20-12-32(31-30-20)11-13-3-8-16-17(14-4-6-15(24)7-5-14)10-19(21(28)33)29-18(16)9-13;1-2-31-23(30)16-11-26-28(13-16)12-14-3-8-18-19(15-4-6-17(24)7-5-15)10-21(22(25)29)27-20(18)9-14;1-30-22(29)15-10-25-27(12-15)11-13-2-7-17-18(14-3-5-16(23)6-4-14)9-20(21(24)28)26-19(17)8-13/h5-13,15,18,25,32H,1-4,14H2,(H2,28,33);3-10,12H,2,11H2,1H3,(H2,29,33);3-10,12,34H,2,11H2,1H3,(H2,28,33);3-11,13H,2,12H2,1H3,(H2,25,29);2-10,12H,11H2,1H3,(H2,24,28)/t;;22-;;/m..0../s1.
What are the key properties of 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate?
4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate has a molecular weight of 2243.65 g/mol, XLogP of 20.37, 29 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-7-[[4-[(2S)-1,1,1-trifluoro-2-hydroxybutan-2-yl]triazol-1-yl]methyl]quinoline-2-carboxamide;7-[[4-[cyclopentyl(hydroxy)methyl]pyrazol-1-yl]methyl]-4-(4-fluorophenyl)quinoline-2-carboxamide;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate;ethyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]-3-(trifluoromethyl)pyrazole-4-carboxylate;methyl 1-[[2-carbamoyl-4-(4-fluorophenyl)quinolin-7-yl]methyl]pyrazole-4-carboxylate is sourced from PubChem (CID 160856442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).