[6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane

C23H25GeNS — CID 165170806

IUPAC[6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane
SMILES[2H]C(C)(C)c1ccnc(-c2cccc3c2sc2c([Ge](C)(C)C)cccc23)c1
InChIInChI=1S/C23H25GeNS/c1-15(2)16-12-13-25-21(14-16)19-10-6-8-17-18-9-7-11-20(24(3,4)5)23(18)26-22(17)19/h6-15H,1-5H3/i15D
InChIKeyGCRNOCHQTDIKHV-RWFJLFJASA-N
MW421.14 g/mol
LogP6.79
Rot. Bonds3

About [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane

[6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane (PubChem CID 165170806) has the molecular formula C23H25GeNS and a molecular weight of 421.14 g/mol. Its IUPAC name is [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane.

Molecular Properties

Compound Name[6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane
PubChem CID165170806
Molecular FormulaC23H25GeNS
Molecular Weight421.14 g/mol
Exact Mass422.10
IUPAC Name[6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane
SMILES[2H]C(C)(C)c1ccnc(-c2cccc3c2sc2c([Ge](C)(C)C)cccc23)c1
InChIInChI=1S/C23H25GeNS/c1-15(2)16-12-13-25-21(14-16)19-10-6-8-17-18-9-7-11-20(24(3,4)5)23(18)26-22(17)19/h6-15H,1-5H3/i15D
InChIKeyGCRNOCHQTDIKHV-RWFJLFJASA-N
XLogP6.79
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.14
LogP ≤ 56.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-deuteriopropan-2-yl)-2-[4-(2-deuteriopropan-2-yl)naphtho[1,2-b][1]benzothiol-10-yl]pyridine
CID 165170907
4-(2-deuteriopropan-2-yl)-2-(1-methylnaphtho[1,2-b][1]benzothiol-10-yl)pyridine
CID 165170798
4-(2-deuteriopropan-2-yl)-2-(3-fluoronaphtho[1,2-b][1]benzothiol-10-yl)pyridine
CID 165171153
4-(2-deuteriopropan-2-yl)-2-[7-(4-methylphenyl)dibenzothiophen-4-yl]pyridine
CID 165171093
8-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]-2-(trideuteriomethyl)-[1]benzothiolo[2,3-b]pyridine
CID 155612410
4-(2-deuteriopropan-2-yl)-2-[7-(3-methylphenyl)dibenzothiophen-4-yl]pyridine
CID 165170640
4-(2-deuteriopropan-2-yl)-2-[7-(1,1-dideuterioethyl)-8-propan-2-yldibenzothiophen-4-yl]pyridine
CID 165170846
4-(2-deuteriopropan-2-yl)-2-(8-methyl-[1]benzothiolo[3,2-b][1]benzofuran-1-yl)pyridine
CID 165170605
4-[(E)-2-deuteriopent-3-en-2-yl]-2-[4-(2-deuteriopropan-2-yl)naphtho[1,2-b][1]benzothiol-10-yl]pyridine
CID 165170987
trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane
CID 164832502
2-[6-(2-deuteriopropan-2-yl)-1-phenyldibenzothiophen-4-yl]-4-propan-2-ylpyridine
CID 166573694
2-[8-(4-phenylphenyl)dibenzothiophen-4-yl]-4-propan-2-ylpyridine
CID 166574431

Frequently Asked Questions

What is the IUPAC name of [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane?
The IUPAC name of [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane (CID 165170806) is [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane.
What is the SMILES notation for [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane?
The canonical SMILES for [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane is [2H]C(C)(C)c1ccnc(-c2cccc3c2sc2c([Ge](C)(C)C)cccc23)c1.
What is the InChIKey of [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane?
The InChIKey is GCRNOCHQTDIKHV-RWFJLFJASA-N. The full InChI is InChI=1S/C23H25GeNS/c1-15(2)16-12-13-25-21(14-16)19-10-6-8-17-18-9-7-11-20(24(3,4)5)23(18)26-22(17)19/h6-15H,1-5H3/i15D.
What are the key properties of [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane?
[6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane has a molecular weight of 421.14 g/mol, XLogP of 6.79, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane is sourced from PubChem (CID 165170806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).