4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide

C135H120Cl5F4N25O19S6 — CID 158772801

IUPAC4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide
SMILESCOc1cc2nccc(Oc3ccc(CC(=S)N4CCC(O)C4)c(Cl)c3F)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(NC(=S)N(C)C)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(NC(=S)NC4CC4)c(Cl)c3)c2cc1C(=O)NCC(F)(F)F.COc1cc2nccc(Oc3ccc(NC(=S)Nc4ccccc4)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(NC(=S)Nc4ccn[nH]4)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc4c(c3)CCCN4C(=S)NC3CC3)c2cc1C(N)=O
InChIInChI=1S/C24H19ClN4O3S.C24H24N4O3S.C23H20ClF3N4O3S.C23H21ClFN3O4S.C21H17ClN6O3S.C20H19ClN4O3S/c1-31-22-13-20-16(12-17(22)23(26)30)21(9-10-27-20)32-15-7-8-19(18(25)11-15)29-24(33)28-14-5-3-2-4-6-14;1-30-22-13-19-17(12-18(22)23(25)29)21(8-9-26-19)31-16-6-7-20-14(11-16)3-2-10-28(20)24(32)27-15-4-5-15;1-33-20-10-18-14(9-15(20)21(32)29-11-23(25,26)27)19(6-7-28-18)34-13-4-5-17(16(24)8-13)31-22(35)30-12-2-3-12;1-31-19-10-16-14(9-15(19)23(26)30)17(4-6-27-16)32-18-3-2-12(21(24)22(18)25)8-20(33)28-7-5-13(29)11-28;1-30-18-10-16-12(9-13(18)20(23)29)17(4-6-24-16)31-11-2-3-15(14(22)8-11)26-21(32)27-19-5-7-25-28-19;1-25(2)20(29)24-15-5-4-11(8-14(15)21)28-17-6-7-23-16-10-18(27-3)13(19(22)26)9-12(16)17/h2-13H,1H3,(H2,26,30)(H2,28,29,33);6-9,11-13,15H,2-5,10H2,1H3,(H2,25,29)(H,27,32);4-10,12H,2-3,11H2,1H3,(H,29,32)(H2,30,31,35);2-4,6,9-10,13,29H,5,7-8,11H2,1H3,(H2,26,30);2-10H,1H3,(H2,23,29)(H3,25,26,27,28,32);4-10H,1-3H3,(H2,22,26)(H,24,29)
InChIKeyIQBXHBLWNIAEQH-UHFFFAOYSA-N
MW2842.26 g/mol
LogP27.18
Rot. Bonds35

About 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide

4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide (PubChem CID 158772801) has the molecular formula C135H120Cl5F4N25O19S6 and a molecular weight of 2842.26 g/mol. Its IUPAC name is 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide.

Molecular Properties

Compound Name4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide
PubChem CID158772801
Molecular FormulaC135H120Cl5F4N25O19S6
Molecular Weight2842.26 g/mol
Exact Mass2837.59
IUPAC Name4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide
SMILESCOc1cc2nccc(Oc3ccc(CC(=S)N4CCC(O)C4)c(Cl)c3F)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(NC(=S)N(C)C)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(NC(=S)NC4CC4)c(Cl)c3)c2cc1C(=O)NCC(F)(F)F.COc1cc2nccc(Oc3ccc(NC(=S)Nc4ccccc4)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(NC(=S)Nc4ccn[nH]4)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc4c(c3)CCCN4C(=S)NC3CC3)c2cc1C(N)=O
InChIInChI=1S/C24H19ClN4O3S.C24H24N4O3S.C23H20ClF3N4O3S.C23H21ClFN3O4S.C21H17ClN6O3S.C20H19ClN4O3S/c1-31-22-13-20-16(12-17(22)23(26)30)21(9-10-27-20)32-15-7-8-19(18(25)11-15)29-24(33)28-14-5-3-2-4-6-14;1-30-22-13-19-17(12-18(22)23(25)29)21(8-9-26-19)31-16-6-7-20-14(11-16)3-2-10-28(20)24(32)27-15-4-5-15;1-33-20-10-18-14(9-15(20)21(32)29-11-23(25,26)27)19(6-7-28-18)34-13-4-5-17(16(24)8-13)31-22(35)30-12-2-3-12;1-31-19-10-16-14(9-15(19)23(26)30)17(4-6-27-16)32-18-3-2-12(21(24)22(18)25)8-20(33)28-7-5-13(29)11-28;1-30-18-10-16-12(9-13(18)20(23)29)17(4-6-24-16)31-11-2-3-15(14(22)8-11)26-21(32)27-19-5-7-25-28-19;1-25(2)20(29)24-15-5-4-11(8-14(15)21)28-17-6-7-23-16-10-18(27-3)13(19(22)26)9-12(16)17/h2-13H,1H3,(H2,26,30)(H2,28,29,33);6-9,11-13,15H,2-5,10H2,1H3,(H2,25,29)(H,27,32);4-10,12H,2-3,11H2,1H3,(H,29,32)(H2,30,31,35);2-4,6,9-10,13,29H,5,7-8,11H2,1H3,(H2,26,30);2-10H,1H3,(H2,23,29)(H3,25,26,27,28,32);4-10H,1-3H3,(H2,22,26)(H,24,29)
InChIKeyIQBXHBLWNIAEQH-UHFFFAOYSA-N
XLogP27.18
TPSA587.52 Ų
H-Bond Donors16
H-Bond Acceptors32
Rotatable Bonds35
Heavy Atoms194
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002842.26
LogP ≤ 527.18
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

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

Analyze 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide with MolForge

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Related Compounds

1-[2-chloro-4-[6-(2-cyclopropylacetyl)-7-methoxyquinolin-4-yl]oxyphenyl]-3-cyclopropylthiourea;4-[3-chloro-4-[(3-hydroxypyrrolidine-1-carbothioyl)amino]phenoxy]-7-methoxyquinoline-6-carboxamide;1-[2-chloro-4-[7-methoxy-6-(4-methoxybutanoyl)quinolin-4-yl]oxyphenyl]-3-cyclopropylthiourea;4-[3-chloro-4-(pyridin-3-ylmethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-[[3-(trifluoromethyl)phenyl]carbamothioylamino]phenoxy]-7-methoxyquinoline-6-carboxamide
CID 158716022
4-[3-chloro-2-fluoro-4-[[(3R)-3-fluoropyrrolidine-1-carbothioyl]amino]phenoxy]-7-methoxyquinoline-6-carboxamide
CID 134334082
4-[3-chloro-4-[[1-(trifluoromethyl)cyclopropyl]carbamothioylamino]phenoxy]-7-methoxyquinoline-6-carboxamide
CID 134333929
4-[3-chloro-4-(cyclopropylcarbamoylamino)phenoxy]-7-methoxy-N-(2-piperidin-1-ylethyl)quinoline-6-carboxamide
CID 58931180
4-[3-chloro-4-[(3-fluoroazetidine-1-carbothioyl)amino]phenoxy]-7-methoxyquinoline-6-carboxamide
CID 134333789
4-[3-chloro-4-[[(Z)-1-(cyclobutylamino)prop-1-enyl]amino]phenoxy]-7-methoxyquinoline-6-carboxamide
CID 145166651
4-[3-chloro-4-[(1,1,1-trifluoro-2-methylpropan-2-yl)carbamothioylamino]phenoxy]-7-methoxyquinoline-6-carboxamide
CID 134333804
4-[3-chloro-4-(cyclopropylcarbamoylamino)phenoxy]-N-(3-hydroxypropyl)-7-methoxyquinoline-6-carboxamide
CID 22936850
phenyl N-[4-(6-carbamoyl-7-methoxyquinolin-4-yl)oxy-2-chlorophenyl]carbamate
CID 22936529
4-[3-chloro-4-(cyclopropylcarbamoylamino)phenoxy]-7-methoxy-N-(2-methoxyethyl)quinoline-6-carboxamide
CID 11540329
4-[3-chloro-4-(cyclopropylcarbamoylamino)phenoxy]-N,7-dimethoxyquinoline-6-carboxamide
CID 10049743
4-[3-chloro-4-[(4-chlorophenyl)methylcarbamothioylamino]phenoxy]-7-methoxyquinoline-6-carboxamide
CID 134333848

Frequently Asked Questions

What is the IUPAC name of 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide?
The IUPAC name of 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide (CID 158772801) is 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide.
What is the SMILES notation for 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide?
The canonical SMILES for 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide is COc1cc2nccc(Oc3ccc(CC(=S)N4CCC(O)C4)c(Cl)c3F)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(NC(=S)N(C)C)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(NC(=S)NC4CC4)c(Cl)c3)c2cc1C(=O)NCC(F)(F)F.COc1cc2nccc(Oc3ccc(NC(=S)Nc4ccccc4)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(NC(=S)Nc4ccn[nH]4)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc4c(c3)CCCN4C(=S)NC3CC3)c2cc1C(N)=O.
What is the InChIKey of 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide?
The InChIKey is IQBXHBLWNIAEQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClN4O3S.C24H24N4O3S.C23H20ClF3N4O3S.C23H21ClFN3O4S.C21H17ClN6O3S.C20H19ClN4O3S/c1-31-22-13-20-16(12-17(22)23(26)30)21(9-10-27-20)32-15-7-8-19(18(25)11-15)29-24(33)28-14-5-3-2-4-6-14;1-30-22-13-19-17(12-18(22)23(25)29)21(8-9-26-19)31-16-6-7-20-14(11-16)3-2-10-28(20)24(32)27-15-4-5-15;1-33-20-10-18-14(9-15(20)21(32)29-11-23(25,26)27)19(6-7-28-18)34-13-4-5-17(16(24)8-13)31-22(35)30-12-2-3-12;1-31-19-10-16-14(9-15(19)23(26)30)17(4-6-27-16)32-18-3-2-12(21(24)22(18)25)8-20(33)28-7-5-13(29)11-28;1-30-18-10-16-12(9-13(18)20(23)29)17(4-6-24-16)31-11-2-3-15(14(22)8-11)26-21(32)27-19-5-7-25-28-19;1-25(2)20(29)24-15-5-4-11(8-14(15)21)28-17-6-7-23-16-10-18(27-3)13(19(22)26)9-12(16)17/h2-13H,1H3,(H2,26,30)(H2,28,29,33);6-9,11-13,15H,2-5,10H2,1H3,(H2,25,29)(H,27,32);4-10,12H,2-3,11H2,1H3,(H,29,32)(H2,30,31,35);2-4,6,9-10,13,29H,5,7-8,11H2,1H3,(H2,26,30);2-10H,1H3,(H2,23,29)(H3,25,26,27,28,32);4-10H,1-3H3,(H2,22,26)(H,24,29).
What are the key properties of 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide?
4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide has a molecular weight of 2842.26 g/mol, XLogP of 27.18, 35 rotatable bonds, 16 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-chloro-4-(cyclopropylcarbamothioylamino)phenoxy]-7-methoxy-N-(2,2,2-trifluoroethyl)quinoline-6-carboxamide;4-[3-chloro-4-(dimethylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-2-fluoro-4-[2-(3-hydroxypyrrolidin-1-yl)-2-sulfanylideneethyl]phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(phenylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-(1H-pyrazol-5-ylcarbamothioylamino)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[[1-(cyclopropylcarbamothioyl)-3,4-dihydro-2H-quinolin-6-yl]oxy]-7-methoxyquinoline-6-carboxamide is sourced from PubChem (CID 158772801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).