2-(1,3-thiazol-2-yl)-1,3-thiazole

C6H4N2S2 — CID 819109

IUPAC2-(1,3-thiazol-2-yl)-1,3-thiazole
SMILESc1csc(-c2nccs2)n1
InChIInChI=1S/C6H4N2S2/c1-3-9-5(7-1)6-8-2-4-10-6/h1-4H
InChIKeySMSLWFZHCONMGQ-UHFFFAOYSA-N
MW168.25 g/mol
LogP2.27
Rot. Bonds1

About 2-(1,3-thiazol-2-yl)-1,3-thiazole

2-(1,3-thiazol-2-yl)-1,3-thiazole (PubChem CID 819109) has the molecular formula C6H4N2S2 and a molecular weight of 168.25 g/mol. Its IUPAC name is 2-(1,3-thiazol-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-(1,3-thiazol-2-yl)-1,3-thiazole
PubChem CID819109
Molecular FormulaC6H4N2S2
Molecular Weight168.25 g/mol
Exact Mass167.98
IUPAC Name2-(1,3-thiazol-2-yl)-1,3-thiazole
SMILESc1csc(-c2nccs2)n1
InChIInChI=1S/C6H4N2S2/c1-3-9-5(7-1)6-8-2-4-10-6/h1-4H
InChIKeySMSLWFZHCONMGQ-UHFFFAOYSA-N
XLogP2.27
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.25
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methylthiazole
CID 77129
1,3-Thiazol-2-ylmethanamine
CID 2756507
Methyl((1,3-thiazol-2-yl)methyl)amine
CID 18939834
1,3-Thiazole-2-carbonitrile
CID 15111480
Thiazole, 2,2'-dithiobis-
CID 357976
1,3-Thiazole-2-carbothioamide
CID 15166172
(1,3-Thiazol-2-yl)methanethiol
CID 13969144
(1,3-Thiazol-2-yl)methanamine hydrochloride
CID 42614216
Thiazole, 2,2'-thiobis-
CID 608243
Thiazole, 2,2'-methylenebis-
CID 642343
4-Bromo-2,2'-bithiazole
CID 91027590
2-Thiazolecarboximidamide
CID 10887911

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-2-yl)-1,3-thiazole?
The IUPAC name of 2-(1,3-thiazol-2-yl)-1,3-thiazole (CID 819109) is 2-(1,3-thiazol-2-yl)-1,3-thiazole.
What is the SMILES notation for 2-(1,3-thiazol-2-yl)-1,3-thiazole?
The canonical SMILES for 2-(1,3-thiazol-2-yl)-1,3-thiazole is c1csc(-c2nccs2)n1.
What is the InChIKey of 2-(1,3-thiazol-2-yl)-1,3-thiazole?
The InChIKey is SMSLWFZHCONMGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2S2/c1-3-9-5(7-1)6-8-2-4-10-6/h1-4H.
What are the key properties of 2-(1,3-thiazol-2-yl)-1,3-thiazole?
2-(1,3-thiazol-2-yl)-1,3-thiazole has a molecular weight of 168.25 g/mol, XLogP of 2.27, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-2-yl)-1,3-thiazole is sourced from PubChem (CID 819109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).