5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione

C110H56N16O12S6Se3Te3 — CID 157423753

About 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione

5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione (PubChem CID 157423753) has the molecular formula C110H56N16O12S6Se3Te3 and a molecular weight of 2605.84 g/mol. Its IUPAC name is 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione.

Molecular Properties

• Compound Name: 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione
• PubChem CID: 157423753
• Molecular Formula: C110H56N16O12S6Se3Te3
• Molecular Weight: 2605.84 g/mol
• Exact Mass: 2613.73
• IUPAC Name: 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione
• SMILES: O=C1C(=Cc2ccc(-n3ccc4cnccc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cnccc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cncnc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cncnc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4nccnc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4nccnc43)[te]2)C(=O)c2cscc21
• InChI: InChI=1S/C19H10N2O2SSe.C19H10N2O2STe.2C18H9N3O2SSe.2C18H9N3O2STe/c2*22-18-13(19(23)15-10-24-9-14(15)18)7-12-1-2-17(25-12)21-6-4-11-8-20-5-3-16(11)21;22-16-11(17(23)13-9-24-8-12(13)16)7-10-1-2-15(25-10)21-6-3-14-18(21)20-5-4-19-14;22-16-12(17(23)14-8-24-7-13(14)16)5-11-1-2-15(25-11)21-4-3-10-6-19-9-20-18(10)21;22-16-11(17(23)13-9-24-8-12(13)16)7-10-1-2-15(25-10)21-6-3-14-18(21)20-5-4-19-14;22-16-12(17(23)14-8-24-7-13(14)16)5-11-1-2-15(25-11)21-4-3-10-6-19-9-20-18(10)21/h2*1-10H;4*1-9H
• InChIKey: BPSIMQQCETUFCJ-UHFFFAOYSA-N
• XLogP: 19.22
• TPSA: 363.32 Ų
• H-Bond Acceptors: 34
• Rotatable Bonds: 12
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2605.84
LogP ≤ 5	19.22
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_4', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione?

The IUPAC name of 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione (CID 157423753) is 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione.

What is the SMILES notation for 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione?

The canonical SMILES for 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione is O=C1C(=Cc2ccc(-n3ccc4cnccc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cnccc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cncnc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cncnc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4nccnc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4nccnc43)[te]2)C(=O)c2cscc21.

What is the InChIKey of 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione?

The InChIKey is BPSIMQQCETUFCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H10N2O2SSe.C19H10N2O2STe.2C18H9N3O2SSe.2C18H9N3O2STe/c2*22-18-13(19(23)15-10-24-9-14(15)18)7-12-1-2-17(25-12)21-6-4-11-8-20-5-3-16(11)21;22-16-11(17(23)13-9-24-8-12(13)16)7-10-1-2-15(25-10)21-6-3-14-18(21)20-5-4-19-14;22-16-12(17(23)14-8-24-7-13(14)16)5-11-1-2-15(25-11)21-4-3-10-6-19-9-20-18(10)21;22-16-11(17(23)13-9-24-8-12(13)16)7-10-1-2-15(25-10)21-6-3-14-18(21)20-5-4-19-14;22-16-12(17(23)14-8-24-7-13(14)16)5-11-1-2-15(25-11)21-4-3-10-6-19-9-20-18(10)21/h2*1-10H;4*1-9H.

What are the key properties of 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione?

5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione has a molecular weight of 2605.84 g/mol, XLogP of 19.22, 12 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(5-pyrrolo[2,3-b]pyrazin-5-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyrazin-5-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[3,2-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-d]pyrimidin-7-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione is sourced from PubChem (CID 157423753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).