trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane

C23H25GeNS — CID 164832484

IUPACtrimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane
SMILESCC(C)c1ccnc(-c2ccc3sc4ccc([Ge](C)(C)C)cc4c3c2)c1
InChIInChI=1S/C23H25GeNS/c1-15(2)16-10-11-25-21(13-16)17-6-8-22-19(12-17)20-14-18(24(3,4)5)7-9-23(20)26-22/h6-15H,1-5H3
InChIKeyTYWKCZVVNGHCBK-UHFFFAOYSA-N
MW420.14 g/mol
LogP6.79
Rot. Bonds3

About trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane

trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane (PubChem CID 164832484) has the molecular formula C23H25GeNS and a molecular weight of 420.14 g/mol. Its IUPAC name is trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane.

Molecular Properties

Compound Nametrimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane
PubChem CID164832484
Molecular FormulaC23H25GeNS
Molecular Weight420.14 g/mol
Exact Mass421.09
IUPAC Nametrimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane
SMILESCC(C)c1ccnc(-c2ccc3sc4ccc([Ge](C)(C)C)cc4c3c2)c1
InChIInChI=1S/C23H25GeNS/c1-15(2)16-10-11-25-21(13-16)17-6-8-22-19(12-17)20-14-18(24(3,4)5)7-9-23(20)26-22/h6-15H,1-5H3
InChIKeyTYWKCZVVNGHCBK-UHFFFAOYSA-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 ≤ 500420.14
LogP ≤ 56.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane?
The IUPAC name of trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane (CID 164832484) is trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane.
What is the SMILES notation for trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane?
The canonical SMILES for trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane is CC(C)c1ccnc(-c2ccc3sc4ccc([Ge](C)(C)C)cc4c3c2)c1.
What is the InChIKey of trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane?
The InChIKey is TYWKCZVVNGHCBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25GeNS/c1-15(2)16-10-11-25-21(13-16)17-6-8-22-19(12-17)20-14-18(24(3,4)5)7-9-23(20)26-22/h6-15H,1-5H3.
What are the key properties of trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane?
trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane has a molecular weight of 420.14 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 trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane is sourced from PubChem (CID 164832484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).