[7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane

C28H34N4O2S3Si2 — CID 102234654

IUPAC[7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane
SMILESCc1nc2c(-c3sc(-c4sc([Si](C)(C)C)c5nc(C)c(C)nc45)c4c3OCCO4)sc([Si](C)(C)C)c2nc1C
InChIInChI=1S/C28H34N4O2S3Si2/c1-13-15(3)31-19-17(29-13)23(36-27(19)38(5,6)7)25-21-22(34-12-11-33-21)26(35-25)24-18-20(28(37-24)39(8,9)10)32-16(4)14(2)30-18/h11-12H2,1-10H3
InChIKeyZIPXJHQGSXXQGQ-UHFFFAOYSA-N
MW610.98 g/mol
LogP7.19
Rot. Bonds4

About [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane

[7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane (PubChem CID 102234654) has the molecular formula C28H34N4O2S3Si2 and a molecular weight of 610.98 g/mol. Its IUPAC name is [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane.

Molecular Properties

Compound Name[7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane
PubChem CID102234654
Molecular FormulaC28H34N4O2S3Si2
Molecular Weight610.98 g/mol
Exact Mass610.14
IUPAC Name[7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane
SMILESCc1nc2c(-c3sc(-c4sc([Si](C)(C)C)c5nc(C)c(C)nc45)c4c3OCCO4)sc([Si](C)(C)C)c2nc1C
InChIInChI=1S/C28H34N4O2S3Si2/c1-13-15(3)31-19-17(29-13)23(36-27(19)38(5,6)7)25-21-22(34-12-11-33-21)26(35-25)24-18-20(28(37-24)39(8,9)10)32-16(4)14(2)30-18/h11-12H2,1-10H3
InChIKeyZIPXJHQGSXXQGQ-UHFFFAOYSA-N
XLogP7.19
TPSA70.02 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500610.98
LogP ≤ 57.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane with MolForge

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Frequently Asked Questions

What is the IUPAC name of [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane?
The IUPAC name of [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane (CID 102234654) is [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane.
What is the SMILES notation for [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane?
The canonical SMILES for [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane is Cc1nc2c(-c3sc(-c4sc([Si](C)(C)C)c5nc(C)c(C)nc45)c4c3OCCO4)sc([Si](C)(C)C)c2nc1C.
What is the InChIKey of [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane?
The InChIKey is ZIPXJHQGSXXQGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H34N4O2S3Si2/c1-13-15(3)31-19-17(29-13)23(36-27(19)38(5,6)7)25-21-22(34-12-11-33-21)26(35-25)24-18-20(28(37-24)39(8,9)10)32-16(4)14(2)30-18/h11-12H2,1-10H3.
What are the key properties of [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane?
[7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane has a molecular weight of 610.98 g/mol, XLogP of 7.19, 4 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [7-[5-(2,3-dimethyl-5-trimethylsilylthieno[3,4-b]pyrazin-7-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2,3-dimethylthieno[3,4-b]pyrazin-5-yl]-trimethylsilane is sourced from PubChem (CID 102234654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).