(8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum

C58H79F3N12O11Pt2-2 — CID 160594437

About (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum

(8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum (PubChem CID 160594437) has the molecular formula C58H79F3N12O11Pt2-2 and a molecular weight of 1567.49 g/mol. Its IUPAC name is (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum.

Molecular Properties

• Compound Name: (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum
• PubChem CID: 160594437
• Molecular Formula: C58H79F3N12O11Pt2-2
• Molecular Weight: 1567.49 g/mol
• Exact Mass: 1566.53
• IUPAC Name: (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum
• SMILES: C.C.C.CC(C)([NH-])C(=O)N[C@H](COCc1ccccc1)C(=O)O.CN1C(=O)N2CCN(C(=O)[C@@H](COCc3ccccc3)NC(=O)C(C)(C)[NH-])C[C@@]2(Cc2ccccn2)C1=O.O=C1N(CC(F)(F)F)C(=O)[C@]2(Cc3ccccn3)CNCCN12.[Pt].[Pt]
• InChI: InChI=1S/C27H33N6O5.C14H15F3N4O2.C14H19N2O4.3CH4.2Pt/c1-26(2,28)23(35)30-21(17-38-16-19-9-5-4-6-10-19)22(34)32-13-14-33-25(37)31(3)24(36)27(33,18-32)15-20-11-7-8-12-29-20;15-14(16,17)9-20-11(22)13(7-10-3-1-2-4-19-10)8-18-5-6-21(13)12(20)23;1-14(2,15)13(19)16-11(12(17)18)9-20-8-10-6-4-3-5-7-10;;;;;/h4-12,21,28H,13-18H2,1-3H3,(H,30,35);1-4,18H,5-9H2;3-7,11,15H,8-9H2,1-2H3,(H,16,19)(H,17,18);3*1H4;;/q-1;;-1;;;;;/t21-,27+;13-;11-;;;;;/m101...../s1
• InChIKey: VNYSEUQDHWWYAU-XUKZREECSA-N
• XLogP: 5.93
• TPSA: 300.92 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 13
• Rotatable Bonds: 19
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1567.49
LogP ≤ 5	5.93
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum?

The IUPAC name of (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum (CID 160594437) is (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum.

What is the SMILES notation for (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum?

The canonical SMILES for (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum is C.C.C.CC(C)([NH-])C(=O)N[C@H](COCc1ccccc1)C(=O)O.CN1C(=O)N2CCN(C(=O)[C@@H](COCc3ccccc3)NC(=O)C(C)(C)[NH-])C[C@@]2(Cc2ccccn2)C1=O.O=C1N(CC(F)(F)F)C(=O)[C@]2(Cc3ccccn3)CNCCN12.[Pt].[Pt].

What is the InChIKey of (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum?

The InChIKey is VNYSEUQDHWWYAU-XUKZREECSA-N. The full InChI is InChI=1S/C27H33N6O5.C14H15F3N4O2.C14H19N2O4.3CH4.2Pt/c1-26(2,28)23(35)30-21(17-38-16-19-9-5-4-6-10-19)22(34)32-13-14-33-25(37)31(3)24(36)27(33,18-32)15-20-11-7-8-12-29-20;15-14(16,17)9-20-11(22)13(7-10-3-1-2-4-19-10)8-18-5-6-21(13)12(20)23;1-14(2,15)13(19)16-11(12(17)18)9-20-8-10-6-4-3-5-7-10;;;;;/h4-12,21,28H,13-18H2,1-3H3,(H,30,35);1-4,18H,5-9H2;3-7,11,15H,8-9H2,1-2H3,(H,16,19)(H,17,18);3*1H4;;/q-1;;-1;;;;;/t21-,27+;13-;11-;;;;;/m101...../s1.

What are the key properties of (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum?

(8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum has a molecular weight of 1567.49 g/mol, XLogP of 5.93, 19 rotatable bonds, 4 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for (8aS)-8a-(pyridin-2-ylmethyl)-2-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1,3-dione;[1-[[(2R)-1-[(8aS)-2-methyl-1,3-dioxo-8a-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]azanide;[1-[[(1R)-1-carboxy-2-phenylmethoxyethyl]amino]-2-methyl-1-oxopropan-2-yl]azanide;methane;platinum is sourced from PubChem (CID 160594437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).