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

C116H62N10O12S6Se3Te3 — CID 158820634

IUPAC5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione
SMILESO=C1C(=Cc2ccc(-n3ccc4ccccc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4ccccc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cccnc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cccnc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4ccncc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4ccncc43)[te]2)C(=O)c2cscc21
InChIInChI=1S/C20H11NO2SSe.C20H11NO2STe.2C19H10N2O2SSe.2C19H10N2O2STe/c2*22-19-14(20(23)16-11-24-10-15(16)19)9-13-5-6-18(25-13)21-8-7-12-3-1-2-4-17(12)21;22-18-13(19(23)15-10-24-9-14(15)18)7-12-1-2-17(25-12)21-6-4-11-3-5-20-8-16(11)21;22-17-13(18(23)15-10-24-9-14(15)17)8-12-3-4-16(25-12)21-7-5-11-2-1-6-20-19(11)21;22-18-13(19(23)15-10-24-9-14(15)18)7-12-1-2-17(25-12)21-6-4-11-3-5-20-8-16(11)21;22-17-13(18(23)15-10-24-9-14(15)17)8-12-3-4-16(25-12)21-7-5-11-2-1-6-20-19(11)21/h2*1-11H;4*1-10H
InChIKeyIVUZTTZFIKNAEU-UHFFFAOYSA-N
MW2599.91 g/mol
LogP22.85
Rot. Bonds12

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

5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione (PubChem CID 158820634) has the molecular formula C116H62N10O12S6Se3Te3 and a molecular weight of 2599.91 g/mol. Its IUPAC name is 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione.

Molecular Properties

Compound Name5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione
PubChem CID158820634
Molecular FormulaC116H62N10O12S6Se3Te3
Molecular Weight2599.91 g/mol
Exact Mass2607.76
IUPAC Name5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione
SMILESO=C1C(=Cc2ccc(-n3ccc4ccccc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4ccccc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cccnc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cccnc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4ccncc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4ccncc43)[te]2)C(=O)c2cscc21
InChIInChI=1S/C20H11NO2SSe.C20H11NO2STe.2C19H10N2O2SSe.2C19H10N2O2STe/c2*22-19-14(20(23)16-11-24-10-15(16)19)9-13-5-6-18(25-13)21-8-7-12-3-1-2-4-17(12)21;22-18-13(19(23)15-10-24-9-14(15)18)7-12-1-2-17(25-12)21-6-4-11-3-5-20-8-16(11)21;22-17-13(18(23)15-10-24-9-14(15)17)8-12-3-4-16(25-12)21-7-5-11-2-1-6-20-19(11)21;22-18-13(19(23)15-10-24-9-14(15)18)7-12-1-2-17(25-12)21-6-4-11-3-5-20-8-16(11)21;22-17-13(18(23)15-10-24-9-14(15)17)8-12-3-4-16(25-12)21-7-5-11-2-1-6-20-19(11)21/h2*1-11H;4*1-10H
InChIKeyIVUZTTZFIKNAEU-UHFFFAOYSA-N
XLogP22.85
TPSA285.98 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds12
Heavy Atoms150
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002599.91
LogP ≤ 522.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

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'}

Analyze 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione?
The IUPAC name of 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione (CID 158820634) is 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione.
What is the SMILES notation for 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione?
The canonical SMILES for 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione is O=C1C(=Cc2ccc(-n3ccc4ccccc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4ccccc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cccnc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4cccnc43)[te]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4ccncc43)[se]2)C(=O)c2cscc21.O=C1C(=Cc2ccc(-n3ccc4ccncc43)[te]2)C(=O)c2cscc21.
What is the InChIKey of 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione?
The InChIKey is IVUZTTZFIKNAEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11NO2SSe.C20H11NO2STe.2C19H10N2O2SSe.2C19H10N2O2STe/c2*22-19-14(20(23)16-11-24-10-15(16)19)9-13-5-6-18(25-13)21-8-7-12-3-1-2-4-17(12)21;22-18-13(19(23)15-10-24-9-14(15)18)7-12-1-2-17(25-12)21-6-4-11-3-5-20-8-16(11)21;22-17-13(18(23)15-10-24-9-14(15)17)8-12-3-4-16(25-12)21-7-5-11-2-1-6-20-19(11)21;22-18-13(19(23)15-10-24-9-14(15)18)7-12-1-2-17(25-12)21-6-4-11-3-5-20-8-16(11)21;22-17-13(18(23)15-10-24-9-14(15)17)8-12-3-4-16(25-12)21-7-5-11-2-1-6-20-19(11)21/h2*1-11H;4*1-10H.
What are the key properties of 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione?
5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione has a molecular weight of 2599.91 g/mol, XLogP of 22.85, 12 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-indol-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-indol-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-b]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-ylselenophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione;5-[(5-pyrrolo[2,3-c]pyridin-1-yltellurophen-2-yl)methylidene]cyclopenta[c]thiophene-4,6-dione is sourced from PubChem (CID 158820634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).