4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine

C98H114Cl4N14O12S3 — CID 159545767

About 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine

4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine (PubChem CID 159545767) has the molecular formula C98H114Cl4N14O12S3 and a molecular weight of 1918.09 g/mol. Its IUPAC name is 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine.

Molecular Properties

• Compound Name: 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine
• PubChem CID: 159545767
• Molecular Formula: C98H114Cl4N14O12S3
• Molecular Weight: 1918.09 g/mol
• Exact Mass: 1914.67
• IUPAC Name: 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine
• SMILES: CCCOc1ccc2c(OC(C)C)cc(-c3coc(NC4CC4)n3)nc2c1Cl.CCCOc1ccc2c(OC(C)C)cc(-c3nc(C)cs3)nc2c1Cl.CCCOc1ccc2c(OC(C)C)cc(-n3ccc(NC(C)C)n3)nc2c1.COc1ccc2c(OC(C)C)cc(-c3nc(NC(C)C)sc3C)nc2c1Cl.COc1nc(-c2cc(OC(C)C)c3ccc(OC)c(Cl)c3n2)cs1
• InChI: InChI=1S/C21H24ClN3O3.C21H28N4O2.C20H24ClN3O2S.C19H21ClN2O2S.C17H17ClN2O3S/c1-4-9-26-17-8-7-14-18(28-12(2)3)10-15(24-20(14)19(17)22)16-11-27-21(25-16)23-13-5-6-13;1-6-11-26-16-7-8-17-18(12-16)23-21(13-19(17)27-15(4)5)25-10-9-20(24-25)22-14(2)3;1-10(2)22-20-24-18(12(5)27-20)14-9-16(26-11(3)4)13-7-8-15(25-6)17(21)19(13)23-14;1-5-8-23-15-7-6-13-16(24-11(2)3)9-14(22-18(13)17(15)20)19-21-12(4)10-25-19;1-9(2)23-14-7-11(12-8-24-17(20-12)22-4)19-16-10(14)5-6-13(21-3)15(16)18/h7-8,10-13H,4-6,9H2,1-3H3,(H,23,25);7-10,12-15H,6,11H2,1-5H3,(H,22,24);7-11H,1-6H3,(H,22,24);6-7,9-11H,5,8H2,1-4H3;5-9H,1-4H3
• InChIKey: METXHIBJUQYMOG-UHFFFAOYSA-N
• XLogP: 27.16
• TPSA: 284.59 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 29
• Rotatable Bonds: 33
• Heavy Atoms: 131
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1918.09
LogP ≤ 5	27.16
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine?

The IUPAC name of 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine (CID 159545767) is 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine.

What is the SMILES notation for 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine?

The canonical SMILES for 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine is CCCOc1ccc2c(OC(C)C)cc(-c3coc(NC4CC4)n3)nc2c1Cl.CCCOc1ccc2c(OC(C)C)cc(-c3nc(C)cs3)nc2c1Cl.CCCOc1ccc2c(OC(C)C)cc(-n3ccc(NC(C)C)n3)nc2c1.COc1ccc2c(OC(C)C)cc(-c3nc(NC(C)C)sc3C)nc2c1Cl.COc1nc(-c2cc(OC(C)C)c3ccc(OC)c(Cl)c3n2)cs1.

What is the InChIKey of 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine?

The InChIKey is METXHIBJUQYMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClN3O3.C21H28N4O2.C20H24ClN3O2S.C19H21ClN2O2S.C17H17ClN2O3S/c1-4-9-26-17-8-7-14-18(28-12(2)3)10-15(24-20(14)19(17)22)16-11-27-21(25-16)23-13-5-6-13;1-6-11-26-16-7-8-17-18(12-16)23-21(13-19(17)27-15(4)5)25-10-9-20(24-25)22-14(2)3;1-10(2)22-20-24-18(12(5)27-20)14-9-16(26-11(3)4)13-7-8-15(25-6)17(21)19(13)23-14;1-5-8-23-15-7-6-13-16(24-11(2)3)9-14(22-18(13)17(15)20)19-21-12(4)10-25-19;1-9(2)23-14-7-11(12-8-24-17(20-12)22-4)19-16-10(14)5-6-13(21-3)15(16)18/h7-8,10-13H,4-6,9H2,1-3H3,(H,23,25);7-10,12-15H,6,11H2,1-5H3,(H,22,24);7-11H,1-6H3,(H,22,24);6-7,9-11H,5,8H2,1-4H3;5-9H,1-4H3.

What are the key properties of 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine?

4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine has a molecular weight of 1918.09 g/mol, XLogP of 27.16, 33 rotatable bonds, 3 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-2-methoxy-1,3-thiazole;4-(8-chloro-7-methoxy-4-propan-2-yloxyquinolin-2-yl)-5-methyl-N-propan-2-yl-1,3-thiazol-2-amine;4-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-N-cyclopropyl-1,3-oxazol-2-amine;2-(8-chloro-4-propan-2-yloxy-7-propoxyquinolin-2-yl)-4-methyl-1,3-thiazole;N-propan-2-yl-1-(4-propan-2-yloxy-7-propoxyquinolin-2-yl)pyrazol-3-amine is sourced from PubChem (CID 159545767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).