(4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one

C147H142Cl2F3N29O20 — CID 160824689

About (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one

(4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one (PubChem CID 160824689) has the molecular formula C147H142Cl2F3N29O20 and a molecular weight of 2762.84 g/mol. Its IUPAC name is (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one.

Molecular Properties

• Compound Name: (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one
• PubChem CID: 160824689
• Molecular Formula: C147H142Cl2F3N29O20
• Molecular Weight: 2762.84 g/mol
• Exact Mass: 2760.03
• IUPAC Name: (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one
• SMILES: CN1C(=O)C2(N=C1N)c1cc(-c3cncnc3)ccc1OC1CC(F)CCC12.CN1C(=O)[C@]2(N=C1N)c1cc(-c3cccc(C#N)c3)ccc1O[C@H]1CCOC[C@@H]12.CN1C(=O)[C@]2(N=C1N)c1cc(-c3cccnc3F)ccc1O[C@H]1CCOC[C@@H]12.CN1C(=O)[C@]2(N=C1N)c1cc(-c3cncc(Cl)c3)ccc1OC1CCOC[C@H]12.C[C@@H]1OCCC2Oc3ccc(-c4cccnc4F)cc3[C@]3(N=C(N)N(C)C3=O)[C@H]21.C[C@H]1OCCC2Oc3ccc(-c4cccc(C#N)c4)cc3[C@]3(N=C(N)N(C)C3=O)[C@@H]21.C[C@H]1OCCC2Oc3ccc(-c4cncc(Cl)c4)cc3[C@]3(N=C(N)N(C)C3=O)[C@@H]21
• InChI: InChI=1S/C23H22N4O3.C22H20N4O3.C21H21ClN4O3.C21H21FN4O3.C20H19ClN4O3.C20H20FN5O2.C20H19FN4O3/c1-13-20-19(8-9-29-13)30-18-7-6-16(15-5-3-4-14(10-15)12-24)11-17(18)23(20)21(28)27(2)22(25)26-23;1-26-20(27)22(25-21(26)24)16-10-15(14-4-2-3-13(9-14)11-23)5-6-18(16)29-19-7-8-28-12-17(19)22;1-11-18-17(5-6-28-11)29-16-4-3-12(13-7-14(22)10-24-9-13)8-15(16)21(18)19(27)26(2)20(23)25-21;1-11-17-16(7-9-28-11)29-15-6-5-12(13-4-3-8-24-18(13)22)10-14(15)21(17)19(27)26(2)20(23)25-21;1-25-18(26)20(24-19(25)22)14-7-11(12-6-13(21)9-23-8-12)2-3-16(14)28-17-4-5-27-10-15(17)20;1-26-18(27)20(25-19(26)22)14-4-3-13(21)7-17(14)28-16-5-2-11(6-15(16)20)12-8-23-10-24-9-12;1-25-18(26)20(24-19(25)22)13-9-11(12-3-2-7-23-17(12)21)4-5-15(13)28-16-6-8-27-10-14(16)20/h3-7,10-11,13,19-20H,8-9H2,1-2H3,(H2,25,26);2-6,9-10,17,19H,7-8,12H2,1H3,(H2,24,25);3-4,7-11,17-18H,5-6H2,1-2H3,(H2,23,25);3-6,8,10-11,16-17H,7,9H2,1-2H3,(H2,23,25);2-3,6-9,15,17H,4-5,10H2,1H3,(H2,22,24);2,5-6,8-10,13-14,17H,3-4,7H2,1H3,(H2,22,25);2-5,7,9,14,16H,6,8,10H2,1H3,(H2,22,24)/t13-,19?,20-,23+;17-,19-,22-;11-,17?,18-,21+;11-,16?,17-,21-;15-,17?,20+;;14-,16-,20-/m10101.0/s1
• InChIKey: SFZRCRBBDNVGBE-AALPOKHQSA-N
• XLogP: 14.90
• TPSA: 655.74 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 42
• Rotatable Bonds: 7
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2762.84
LogP ≤ 5	14.90
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	42

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one?

The IUPAC name of (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one (CID 160824689) is (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one.

What is the SMILES notation for (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one?

The canonical SMILES for (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one is CN1C(=O)C2(N=C1N)c1cc(-c3cncnc3)ccc1OC1CC(F)CCC12.CN1C(=O)[C@]2(N=C1N)c1cc(-c3cccc(C#N)c3)ccc1O[C@H]1CCOC[C@@H]12.CN1C(=O)[C@]2(N=C1N)c1cc(-c3cccnc3F)ccc1O[C@H]1CCOC[C@@H]12.CN1C(=O)[C@]2(N=C1N)c1cc(-c3cncc(Cl)c3)ccc1OC1CCOC[C@H]12.C[C@@H]1OCCC2Oc3ccc(-c4cccnc4F)cc3[C@]3(N=C(N)N(C)C3=O)[C@H]21.C[C@H]1OCCC2Oc3ccc(-c4cccc(C#N)c4)cc3[C@]3(N=C(N)N(C)C3=O)[C@@H]21.C[C@H]1OCCC2Oc3ccc(-c4cncc(Cl)c4)cc3[C@]3(N=C(N)N(C)C3=O)[C@@H]21.

What is the InChIKey of (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one?

The InChIKey is SFZRCRBBDNVGBE-AALPOKHQSA-N. The full InChI is InChI=1S/C23H22N4O3.C22H20N4O3.C21H21ClN4O3.C21H21FN4O3.C20H19ClN4O3.C20H20FN5O2.C20H19FN4O3/c1-13-20-19(8-9-29-13)30-18-7-6-16(15-5-3-4-14(10-15)12-24)11-17(18)23(20)21(28)27(2)22(25)26-23;1-26-20(27)22(25-21(26)24)16-10-15(14-4-2-3-13(9-14)11-23)5-6-18(16)29-19-7-8-28-12-17(19)22;1-11-18-17(5-6-28-11)29-16-4-3-12(13-7-14(22)10-24-9-13)8-15(16)21(18)19(27)26(2)20(23)25-21;1-11-17-16(7-9-28-11)29-15-6-5-12(13-4-3-8-24-18(13)22)10-14(15)21(17)19(27)26(2)20(23)25-21;1-25-18(26)20(24-19(25)22)14-7-11(12-6-13(21)9-23-8-12)2-3-16(14)28-17-4-5-27-10-15(17)20;1-26-18(27)20(25-19(26)22)14-4-3-13(21)7-17(14)28-16-5-2-11(6-15(16)20)12-8-23-10-24-9-12;1-25-18(26)20(24-19(25)22)13-9-11(12-3-2-7-23-17(12)21)4-5-15(13)28-16-6-8-27-10-14(16)20/h3-7,10-11,13,19-20H,8-9H2,1-2H3,(H2,25,26);2-6,9-10,17,19H,7-8,12H2,1H3,(H2,24,25);3-4,7-11,17-18H,5-6H2,1-2H3,(H2,23,25);3-6,8,10-11,16-17H,7,9H2,1-2H3,(H2,23,25);2-3,6-9,15,17H,4-5,10H2,1H3,(H2,22,24);2,5-6,8-10,13-14,17H,3-4,7H2,1H3,(H2,22,25);2-5,7,9,14,16H,6,8,10H2,1H3,(H2,22,24)/t13-,19?,20-,23+;17-,19-,22-;11-,17?,18-,21+;11-,16?,17-,21-;15-,17?,20+;;14-,16-,20-/m10101.0/s1.

What are the key properties of (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one?

(4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one has a molecular weight of 2762.84 g/mol, XLogP of 14.90, 7 rotatable bonds, 7 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for (4aS,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(4aS,10R,10aS)-2'-amino-1'-methyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1R,10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;(10R,10aR)-2'-amino-8-(5-chloro-3-pyridinyl)-3'-methylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;3-[(1R,10R,10aR)-2'-amino-1,1'-dimethyl-5'-oxospiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,4'-imidazole]-8-yl]benzonitrile;(1S,10R,10aS)-2'-amino-8-(2-fluoro-3-pyridinyl)-1,3'-dimethylspiro[3,4,4a,10a-tetrahydro-1H-pyrano[4,3-b]chromene-10,5'-imidazole]-4'-one;2'-amino-3-fluoro-3'-methyl-7-pyrimidin-5-ylspiro[1,2,3,4,4a,9a-hexahydroxanthene-9,5'-imidazole]-4'-one is sourced from PubChem (CID 160824689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).