6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium

C11H12CrN2O3S — CID 10881248

IUPAC6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium
SMILESO=[Cr](=O)=O.c1ccc(C2CN3CCSC3=N2)cc1
InChIInChI=1S/C11H12N2S.Cr.3O/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10;;;;/h1-5,10H,6-8H2;;;;
InChIKeyZRYGZGDZJWNUTA-UHFFFAOYSA-N
MW304.29 g/mol
LogP1.79
Rot. Bonds1

About 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium

6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium (PubChem CID 10881248) has the molecular formula C11H12CrN2O3S and a molecular weight of 304.29 g/mol. Its IUPAC name is 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium.

Molecular Properties

Compound Name6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium
PubChem CID10881248
Molecular FormulaC11H12CrN2O3S
Molecular Weight304.29 g/mol
Exact Mass304.00
IUPAC Name6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium
SMILESO=[Cr](=O)=O.c1ccc(C2CN3CCSC3=N2)cc1
InChIInChI=1S/C11H12N2S.Cr.3O/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10;;;;/h1-5,10H,6-8H2;;;;
InChIKeyZRYGZGDZJWNUTA-UHFFFAOYSA-N
XLogP1.79
TPSA66.81 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.29
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium?
The IUPAC name of 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium (CID 10881248) is 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium.
What is the SMILES notation for 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium?
The canonical SMILES for 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium is O=[Cr](=O)=O.c1ccc(C2CN3CCSC3=N2)cc1.
What is the InChIKey of 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium?
The InChIKey is ZRYGZGDZJWNUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S.Cr.3O/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10;;;;/h1-5,10H,6-8H2;;;;.
What are the key properties of 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium?
6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium has a molecular weight of 304.29 g/mol, XLogP of 1.79, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;trioxochromium is sourced from PubChem (CID 10881248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).