4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol

C11H10N2O3S — CID 86249941

IUPAC4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol
SMILESO=S1(=O)CCn2cc(-c3ccc(O)cc3)nc21
InChIInChI=1S/C11H10N2O3S/c14-9-3-1-8(2-4-9)10-7-13-5-6-17(15,16)11(13)12-10/h1-4,7,14H,5-6H2
InChIKeyISGOSWWOQJZRBI-UHFFFAOYSA-N
MW250.28 g/mol
LogP1.04
Rot. Bonds1

About 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol

4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol (PubChem CID 86249941) has the molecular formula C11H10N2O3S and a molecular weight of 250.28 g/mol. Its IUPAC name is 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol.

Molecular Properties

Compound Name4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol
PubChem CID86249941
Molecular FormulaC11H10N2O3S
Molecular Weight250.28 g/mol
Exact Mass250.04
IUPAC Name4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol
SMILESO=S1(=O)CCn2cc(-c3ccc(O)cc3)nc21
InChIInChI=1S/C11H10N2O3S/c14-9-3-1-8(2-4-9)10-7-13-5-6-17(15,16)11(13)12-10/h1-4,7,14H,5-6H2
InChIKeyISGOSWWOQJZRBI-UHFFFAOYSA-N
XLogP1.04
TPSA72.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol?
The IUPAC name of 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol (CID 86249941) is 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol.
What is the SMILES notation for 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol?
The canonical SMILES for 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol is O=S1(=O)CCn2cc(-c3ccc(O)cc3)nc21.
What is the InChIKey of 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol?
The InChIKey is ISGOSWWOQJZRBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3S/c14-9-3-1-8(2-4-9)10-7-13-5-6-17(15,16)11(13)12-10/h1-4,7,14H,5-6H2.
What are the key properties of 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol?
4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol has a molecular weight of 250.28 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,1-dioxo-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenol is sourced from PubChem (CID 86249941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).