2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol

C12H8N2OS2 — CID 136930256

IUPAC2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol
SMILESOc1ccccc1-c1nc(-c2cscn2)cs1
InChIInChI=1S/C12H8N2OS2/c15-11-4-2-1-3-8(11)12-14-10(6-17-12)9-5-16-7-13-9/h1-7,15H
InChIKeyRAKONLMIZMOSDZ-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.64
Rot. Bonds2

About 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol

2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol (PubChem CID 136930256) has the molecular formula C12H8N2OS2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol.

Molecular Properties

Compound Name2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol
PubChem CID136930256
Molecular FormulaC12H8N2OS2
Molecular Weight260.34 g/mol
Exact Mass260.01
IUPAC Name2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol
SMILESOc1ccccc1-c1nc(-c2cscn2)cs1
InChIInChI=1S/C12H8N2OS2/c15-11-4-2-1-3-8(11)12-14-10(6-17-12)9-5-16-7-13-9/h1-7,15H
InChIKeyRAKONLMIZMOSDZ-UHFFFAOYSA-N
XLogP3.64
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(4-bromothiophen-2-yl)-1,3-thiazol-2-yl]phenol
CID 136849095
2-[2-(1H-indazol-3-yl)-1,3-thiazol-4-yl]phenol
CID 22259251
4-fluoro-2-(1,3-thiazol-4-yl)phenol
CID 97033771
4-methyl-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)phenol
CID 136843777
2-[3-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-5-yl]benzene-1,3-diol
CID 136813506
2-[4-(2-methylpyrazol-3-yl)-1,3-thiazol-2-yl]phenol
CID 137000832
2-(1,3-thiazol-4-yl)benzamide
CID 140649331
2-(4-ethynyl-1,3-thiazol-2-yl)phenol
CID 136801055
2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]guanidine;dihydrobromide
CID 23321326
2-[2-(hydroxymethyl)-1,3-thiazol-4-yl]phenol
CID 105460333
4-methyl-2-(1,3-thiazol-4-yl)-1,3-thiazole
CID 91325706
2-(1,3,4-thiadiazol-2-yl)phenol
CID 135744207

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol?
The IUPAC name of 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol (CID 136930256) is 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol.
What is the SMILES notation for 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol?
The canonical SMILES for 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol is Oc1ccccc1-c1nc(-c2cscn2)cs1.
What is the InChIKey of 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol?
The InChIKey is RAKONLMIZMOSDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2OS2/c15-11-4-2-1-3-8(11)12-14-10(6-17-12)9-5-16-7-13-9/h1-7,15H.
What are the key properties of 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol?
2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol has a molecular weight of 260.34 g/mol, XLogP of 3.64, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1,3-thiazol-4-yl)-1,3-thiazol-2-yl]phenol is sourced from PubChem (CID 136930256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).