(1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one

C150H155BrN26O11S5 — CID 158375811

About (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one

(1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one (PubChem CID 158375811) has the molecular formula C150H155BrN26O11S5 and a molecular weight of 2738.30 g/mol. Its IUPAC name is (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one.

Molecular Properties

• Compound Name: (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one
• PubChem CID: 158375811
• Molecular Formula: C150H155BrN26O11S5
• Molecular Weight: 2738.30 g/mol
• Exact Mass: 2735.02
• IUPAC Name: (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one
• SMILES: C=C[C@@H](Cn1cc(-c2ccc(Br)cc2)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1.C=C[C@@H](Cn1cc(-c2ccc(Oc3ccccc3)cc2)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1.C=C[C@@H](Cn1cc(C2(O)CCCC2)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1.C=C[C@@H](Cn1cc(CCCO)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1.C=C[C@@H](Cn1cc(CON2C(=O)c3ccccc3C2=O)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1
• InChI: InChI=1S/C35H33N5O2S.C32H30N6O4S.C29H28BrN5OS.C28H33N5O2S.C26H31N5O2S/c1-3-24(21-39-22-32(37-38-39)25-10-12-28(13-11-25)42-27-7-5-4-6-8-27)26-16-18-40-33(20-26)34(43-35(40)41)29-15-17-36-31-14-9-23(2)19-30(29)31;1-3-20(16-36-17-22(34-35-36)18-42-38-30(39)24-6-4-5-7-25(24)31(38)40)21-11-13-37-28(15-21)29(43-32(37)41)23-10-12-33-27-9-8-19(2)14-26(23)27;1-3-19(16-34-17-26(32-33-34)20-5-7-22(30)8-6-20)21-11-13-35-27(15-21)28(37-29(35)36)23-10-12-31-25-9-4-18(2)14-24(23)25;1-3-19(16-32-17-25(30-31-32)28(35)10-4-5-11-28)20-9-13-33-24(15-20)26(36-27(33)34)21-8-12-29-23-7-6-18(2)14-22(21)23;1-3-18(15-30-16-20(28-29-30)5-4-12-32)19-9-11-31-24(14-19)25(34-26(31)33)21-8-10-27-23-7-6-17(2)13-22(21)23/h3-15,17,19,22,24,26,33-34H,1,16,18,20-21H2,2H3;3-10,12,14,17,20-21,28-29H,1,11,13,15-16,18H2,2H3;3-10,12,14,17,19,21,27-28H,1,11,13,15-16H2,2H3;3,6-8,12,14,17,19-20,24,26,35H,1,4-5,9-11,13,15-16H2,2H3;3,6-8,10,13,16,18-19,24-25,32H,1,4-5,9,11-12,14-15H2,2H3/t24-,26-,33-,34-;20-,21-,28-,29-;19-,21-,27-,28-;19-,20-,24-,26-;18-,19-,24-,25-/m00000/s1
• InChIKey: GVEGIQCCDFKQOV-NYOXTQFFSA-N
• XLogP: 30.43
• TPSA: 415.85 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 36
• Rotatable Bonds: 36
• Heavy Atoms: 193
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2738.30
LogP ≤ 5	30.43
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'thioester', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one?

The IUPAC name of (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one (CID 158375811) is (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one.

What is the SMILES notation for (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one?

The canonical SMILES for (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one is C=C[C@@H](Cn1cc(-c2ccc(Br)cc2)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1.C=C[C@@H](Cn1cc(-c2ccc(Oc3ccccc3)cc2)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1.C=C[C@@H](Cn1cc(C2(O)CCCC2)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1.C=C[C@@H](Cn1cc(CCCO)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1.C=C[C@@H](Cn1cc(CON2C(=O)c3ccccc3C2=O)nn1)[C@H]1CCN2C(=O)S[C@@H](c3ccnc4ccc(C)cc34)[C@@H]2C1.

What is the InChIKey of (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one?

The InChIKey is GVEGIQCCDFKQOV-NYOXTQFFSA-N. The full InChI is InChI=1S/C35H33N5O2S.C32H30N6O4S.C29H28BrN5OS.C28H33N5O2S.C26H31N5O2S/c1-3-24(21-39-22-32(37-38-39)25-10-12-28(13-11-25)42-27-7-5-4-6-8-27)26-16-18-40-33(20-26)34(43-35(40)41)29-15-17-36-31-14-9-23(2)19-30(29)31;1-3-20(16-36-17-22(34-35-36)18-42-38-30(39)24-6-4-5-7-25(24)31(38)40)21-11-13-37-28(15-21)29(43-32(37)41)23-10-12-33-27-9-8-19(2)14-26(23)27;1-3-19(16-34-17-26(32-33-34)20-5-7-22(30)8-6-20)21-11-13-35-27(15-21)28(37-29(35)36)23-10-12-31-25-9-4-18(2)14-24(23)25;1-3-19(16-32-17-25(30-31-32)28(35)10-4-5-11-28)20-9-13-33-24(15-20)26(36-27(33)34)21-8-12-29-23-7-6-18(2)14-22(21)23;1-3-18(15-30-16-20(28-29-30)5-4-12-32)19-9-11-31-24(14-19)25(34-26(31)33)21-8-10-27-23-7-6-17(2)13-22(21)23/h3-15,17,19,22,24,26,33-34H,1,16,18,20-21H2,2H3;3-10,12,14,17,20-21,28-29H,1,11,13,15-16,18H2,2H3;3-10,12,14,17,19,21,27-28H,1,11,13,15-16H2,2H3;3,6-8,12,14,17,19-20,24,26,35H,1,4-5,9-11,13,15-16H2,2H3;3,6-8,10,13,16,18-19,24-25,32H,1,4-5,9,11-12,14-15H2,2H3/t24-,26-,33-,34-;20-,21-,28-,29-;19-,21-,27-,28-;19-,20-,24-,26-;18-,19-,24-,25-/m00000/s1.

What are the key properties of (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one?

(1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one has a molecular weight of 2738.30 g/mol, XLogP of 30.43, 36 rotatable bonds, 2 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for (1S,7S,8aS)-7-[(2R)-1-[4-(4-bromophenyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(1-hydroxycyclopentyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;(1S,7S,8aS)-7-[(2R)-1-[4-(3-hydroxypropyl)triazol-1-yl]but-3-en-2-yl]-1-(6-methylquinolin-4-yl)-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one;2-[[1-[(2R)-2-[(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enyl]triazol-4-yl]methoxy]isoindole-1,3-dione;(1S,7S,8aS)-1-(6-methylquinolin-4-yl)-7-[(2R)-1-[4-(4-phenoxyphenyl)triazol-1-yl]but-3-en-2-yl]-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-3-one is sourced from PubChem (CID 158375811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).