5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole

C10H13BrN2S2 — CID 162221679

IUPAC5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole
SMILESCc1csc(C)n1.Cc1nc(C)c(Br)s1
InChIInChI=1S/C5H6BrNS.C5H7NS/c1-3-5(6)8-4(2)7-3;1-4-3-7-5(2)6-4/h1-2H3;3H,1-2H3
InChIKeyZUFBFHJPZIUKDX-UHFFFAOYSA-N
MW305.27 g/mol
LogP4.28
Rot. Bonds

About 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole

5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole (PubChem CID 162221679) has the molecular formula C10H13BrN2S2 and a molecular weight of 305.27 g/mol. Its IUPAC name is 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole
PubChem CID162221679
Molecular FormulaC10H13BrN2S2
Molecular Weight305.27 g/mol
Exact Mass303.97
IUPAC Name5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole
SMILESCc1csc(C)n1.Cc1nc(C)c(Br)s1
InChIInChI=1S/C5H6BrNS.C5H7NS/c1-3-5(6)8-4(2)7-3;1-4-3-7-5(2)6-4/h1-2H3;3H,1-2H3
InChIKeyZUFBFHJPZIUKDX-UHFFFAOYSA-N
XLogP4.28
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.27
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,2'-(1,2-Ethanediyl)bis(4-methyl-1,3-thiazole)
CID 969581
2-Methyl-5-(((2-methylthiazol-4-yl)methyl)thio)-1,3,4-thiadiazole
CID 752198
4-(Bromomethyl)-2-methyl-1,3-thiazole
CID 22121308
4,4Dimethyl-2,2bithiazolyl
CID 21779250
2,2'-Bithiazole, 4,4'-bis(bromomethyl)-
CID 638954
5-Bromo-2-(5-bromo-4-methyl-1,3-thiazol-2-yl)-4-methyl-1,3-thiazole
CID 21779251
4-methyl-2-[(Z)-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]-1,3-thiazole
CID 134908211
1,2-Bis(4-methylthiazol-2-yl)disulfane
CID 4067549
2-[4-(Bromomethyl)-1,3-thiazol-2-yl]-4-methyl-1,3-thiazole
CID 85701265
4-Methyl-2-[2-[(4-methyl-1,3-thiazol-2-yl)disulfanyl]ethyldisulfanyl]-1,3-thiazole
CID 85821858
4-[Bromo(dideuterio)methyl]-2-(trideuteriomethyl)-1,3-thiazole
CID 88993293
Bis(4-methylthiazol-2-yl)methylene
CID 115573824

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole?
The IUPAC name of 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole (CID 162221679) is 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole.
What is the SMILES notation for 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole?
The canonical SMILES for 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole is Cc1csc(C)n1.Cc1nc(C)c(Br)s1.
What is the InChIKey of 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole?
The InChIKey is ZUFBFHJPZIUKDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6BrNS.C5H7NS/c1-3-5(6)8-4(2)7-3;1-4-3-7-5(2)6-4/h1-2H3;3H,1-2H3.
What are the key properties of 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole?
5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole has a molecular weight of 305.27 g/mol, XLogP of 4.28, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2,4-dimethyl-1,3-thiazole;2,4-dimethyl-1,3-thiazole is sourced from PubChem (CID 162221679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).