trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane

C29H29GeNS — CID 164832502

IUPACtrimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane
SMILESCC(C)c1ccnc(-c2cccc3c2sc2cc(-c4ccc([Ge](C)(C)C)cc4)ccc23)c1
InChIInChI=1S/C29H29GeNS/c1-19(2)21-15-16-31-27(17-21)26-8-6-7-25-24-14-11-22(18-28(24)32-29(25)26)20-9-12-23(13-10-20)30(3,4)5/h6-19H,1-5H3
InChIKeyYROKALRPSVWEDE-UHFFFAOYSA-N
MW496.24 g/mol
LogP8.45
Rot. Bonds4

About trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane

trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane (PubChem CID 164832502) has the molecular formula C29H29GeNS and a molecular weight of 496.24 g/mol. Its IUPAC name is trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane.

Molecular Properties

Compound Nametrimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane
PubChem CID164832502
Molecular FormulaC29H29GeNS
Molecular Weight496.24 g/mol
Exact Mass497.12
IUPAC Nametrimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane
SMILESCC(C)c1ccnc(-c2cccc3c2sc2cc(-c4ccc([Ge](C)(C)C)cc4)ccc23)c1
InChIInChI=1S/C29H29GeNS/c1-19(2)21-15-16-31-27(17-21)26-8-6-7-25-24-14-11-22(18-28(24)32-29(25)26)20-9-12-23(13-10-20)30(3,4)5/h6-19H,1-5H3
InChIKeyYROKALRPSVWEDE-UHFFFAOYSA-N
XLogP8.45
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500496.24
LogP ≤ 58.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-deuteriopropan-2-yl)-2-[7-(4-methylphenyl)dibenzothiophen-4-yl]pyridine
CID 165171093
2-[8-(4-phenylphenyl)dibenzothiophen-4-yl]-4-propan-2-ylpyridine
CID 166574431
4-(2-deuteriopropan-2-yl)-2-[7-(3-methylphenyl)dibenzothiophen-4-yl]pyridine
CID 165170640
[1-deuterio-1-[2-[7-(4-fluorophenyl)dibenzothiophen-4-yl]-4-pyridinyl]ethyl]-trimethylgermane
CID 165170727
trimethyl-(6-pyridin-2-yldibenzothiophen-3-yl)germane
CID 164832342
[6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]dibenzothiophen-4-yl]-trimethylgermane
CID 165170806
4-[1-deuterio-1-(4-fluorophenyl)ethyl]-2-[7-(2,6-dimethylphenyl)dibenzothiophen-4-yl]pyridine
CID 165170725
2-[7-(4-fluorophenyl)dibenzothiophen-4-yl]pyridine
CID 166574663
2-(9-phenyldibenzothiophen-3-yl)-4-propan-2-ylpyridine
CID 166576650
[4-[6-[4-(2-deuteriopropan-2-yl)-2-pyridinyl]-7H-dibenzothiophen-7-id-3-yl]phenyl]-trimethylgermane;iridium;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 166577315
4-(2-deuteriopropan-2-yl)-2-[4-(2-deuteriopropan-2-yl)naphtho[1,2-b][1]benzothiol-10-yl]pyridine
CID 165170907
trimethyl-[8-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-2-yl]germane
CID 164832484

Frequently Asked Questions

What is the IUPAC name of trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane?
The IUPAC name of trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane (CID 164832502) is trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane.
What is the SMILES notation for trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane?
The canonical SMILES for trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane is CC(C)c1ccnc(-c2cccc3c2sc2cc(-c4ccc([Ge](C)(C)C)cc4)ccc23)c1.
What is the InChIKey of trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane?
The InChIKey is YROKALRPSVWEDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H29GeNS/c1-19(2)21-15-16-31-27(17-21)26-8-6-7-25-24-14-11-22(18-28(24)32-29(25)26)20-9-12-23(13-10-20)30(3,4)5/h6-19H,1-5H3.
What are the key properties of trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane?
trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane has a molecular weight of 496.24 g/mol, XLogP of 8.45, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-[6-(4-propan-2-yl-2-pyridinyl)dibenzothiophen-3-yl]phenyl]germane is sourced from PubChem (CID 164832502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).