dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate

C63H74BBrCl2F4K2N12O9S2 — CID 157179147

About dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate

dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate (PubChem CID 157179147) has the molecular formula C63H74BBrCl2F4K2N12O9S2 and a molecular weight of 1523.30 g/mol. Its IUPAC name is dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate.

Molecular Properties

• Compound Name: dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate
• PubChem CID: 157179147
• Molecular Formula: C63H74BBrCl2F4K2N12O9S2
• Molecular Weight: 1523.30 g/mol
• Exact Mass: 1520.30
• IUPAC Name: dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate
• SMILES: CC(Cl)Cl.CC1C(=O)N(C)Cc2c(-c3cccc4nc(-c5cnn(C)c5)c(C(F)F)cc34)nc(C3CCS(=O)CC3)n21.CC1C(=O)N(C)Cc2c(Br)nc(C3CCS(=O)CC3)n21.Cn1cc(-c2nc3cccc(B4OC(C)(C)C(C)(C)O4)c3cc2C(F)F)cn1.O=CO[O-].[H-].[K+].[K+]
• InChI: InChI=1S/C27H28F2N6O2S.C20H22BF2N3O2.C13H18BrN3O2S.C2H4Cl2.CH2O3.2K.H/c1-15-27(36)33(2)14-22-24(32-26(35(15)22)16-7-9-38(37)10-8-16)18-5-4-6-21-19(18)11-20(25(28)29)23(31-21)17-12-30-34(3)13-17;1-19(2)20(3,4)28-21(27-19)15-7-6-8-16-13(15)9-14(18(22)23)17(25-16)12-10-24-26(5)11-12;1-8-13(18)16(2)7-10-11(14)15-12(17(8)10)9-3-5-20(19)6-4-9;1-2(3)4;2-1-4-3;;;/h4-6,11-13,15-16,25H,7-10,14H2,1-3H3;6-11,18H,1-5H3;8-9H,3-7H2,1-2H3;2H,1H3;1,3H;;;/q;;;;;2*+1;-1/p-1
• InChIKey: NAHVDFAMIABVKO-UHFFFAOYSA-M
• XLogP: 4.64
• TPSA: 239.64 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 9
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1523.30
LogP ≤ 5	4.64
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate?

The IUPAC name of dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate (CID 157179147) is dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate.

What is the SMILES notation for dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate?

The canonical SMILES for dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate is CC(Cl)Cl.CC1C(=O)N(C)Cc2c(-c3cccc4nc(-c5cnn(C)c5)c(C(F)F)cc34)nc(C3CCS(=O)CC3)n21.CC1C(=O)N(C)Cc2c(Br)nc(C3CCS(=O)CC3)n21.Cn1cc(-c2nc3cccc(B4OC(C)(C)C(C)(C)O4)c3cc2C(F)F)cn1.O=CO[O-].[H-].[K+].[K+].

What is the InChIKey of dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate?

The InChIKey is NAHVDFAMIABVKO-UHFFFAOYSA-M. The full InChI is InChI=1S/C27H28F2N6O2S.C20H22BF2N3O2.C13H18BrN3O2S.C2H4Cl2.CH2O3.2K.H/c1-15-27(36)33(2)14-22-24(32-26(35(15)22)16-7-9-38(37)10-8-16)18-5-4-6-21-19(18)11-20(25(28)29)23(31-21)17-12-30-34(3)13-17;1-19(2)20(3,4)28-21(27-19)15-7-6-8-16-13(15)9-14(18(22)23)17(25-16)12-10-24-26(5)11-12;1-8-13(18)16(2)7-10-11(14)15-12(17(8)10)9-3-5-20(19)6-4-9;1-2(3)4;2-1-4-3;;;/h4-6,11-13,15-16,25H,7-10,14H2,1-3H3;6-11,18H,1-5H3;8-9H,3-7H2,1-2H3;2H,1H3;1,3H;;;/q;;;;;2*+1;-1/p-1.

What are the key properties of dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate?

dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate has a molecular weight of 1523.30 g/mol, XLogP of 4.64, 9 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;1-bromo-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;1,1-dichloroethane;1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-3-(1-oxothian-4-yl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline;hydride;oxido formate is sourced from PubChem (CID 157179147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).