2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole

C11H9Cl2NS — CID 143281745

IUPAC2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole
SMILESCc1nc(-c2cccc(Cl)c2Cl)sc1C
InChIInChI=1S/C11H9Cl2NS/c1-6-7(2)15-11(14-6)8-4-3-5-9(12)10(8)13/h3-5H,1-2H3
InChIKeyXJZHCHVEHVHCSI-UHFFFAOYSA-N
MW258.17 g/mol
LogP4.73
Rot. Bonds1

About 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole

2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole (PubChem CID 143281745) has the molecular formula C11H9Cl2NS and a molecular weight of 258.17 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole
PubChem CID143281745
Molecular FormulaC11H9Cl2NS
Molecular Weight258.17 g/mol
Exact Mass256.98
IUPAC Name2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole
SMILESCc1nc(-c2cccc(Cl)c2Cl)sc1C
InChIInChI=1S/C11H9Cl2NS/c1-6-7(2)15-11(14-6)8-4-3-5-9(12)10(8)13/h3-5H,1-2H3
InChIKeyXJZHCHVEHVHCSI-UHFFFAOYSA-N
XLogP4.73
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.17
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-4-methyl-1,3-thiazol-5-amine
CID 96589922
1-(2,3-dichlorophenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylethanamine
CID 105019795
[2-(2-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]methanol
CID 22647489
2-(2,3-dichlorophenyl)-4-methyl-N-(2-piperidin-1-ylethyl)-1,3-thiazole-5-carboxamide
CID 59337953
1-(2,6-dichlorophenyl)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylmethanamine
CID 61331729
2-(2,3-dichlorophenyl)-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one
CID 63446963
3-(2,3-dichlorophenyl)-4-methylthiophene
CID 130088701
4-(4-bromophenyl)-2-(2-chlorophenyl)-5-methyl-1,3-thiazole
CID 79839841
N-[[2-(2,3-dichlorophenyl)-1,3-thiazol-4-yl]methyl]propan-1-amine
CID 61280692
4-(2-bromophenyl)-2-(3-chloro-2-fluorophenyl)-5-methyl-1,3-thiazole
CID 79832738
3,5-bis(2,3-dichlorophenyl)-4-methyl-1,2,4-triazole
CID 11617680
5-(2,3-dichlorophenyl)-6-methylpyrazin-2-amine
CID 142143814

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole?
The IUPAC name of 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole (CID 143281745) is 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole?
The canonical SMILES for 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole is Cc1nc(-c2cccc(Cl)c2Cl)sc1C.
What is the InChIKey of 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole?
The InChIKey is XJZHCHVEHVHCSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2NS/c1-6-7(2)15-11(14-6)8-4-3-5-9(12)10(8)13/h3-5H,1-2H3.
What are the key properties of 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole?
2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole has a molecular weight of 258.17 g/mol, XLogP of 4.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-4,5-dimethyl-1,3-thiazole is sourced from PubChem (CID 143281745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).