5-chloro-2,4-dimethyl-1,3-thiazole

C5H6ClNS — CID 20719823

IUPAC5-chloro-2,4-dimethyl-1,3-thiazole
SMILESCc1nc(C)c(Cl)s1
InChIInChI=1S/C5H6ClNS/c1-3-5(6)8-4(2)7-3/h1-2H3
InChIKeyKSVOOXKOWOCYLP-UHFFFAOYSA-N
MW147.63 g/mol
LogP2.41
Rot. Bonds

About 5-chloro-2,4-dimethyl-1,3-thiazole

5-chloro-2,4-dimethyl-1,3-thiazole (PubChem CID 20719823) has the molecular formula C5H6ClNS and a molecular weight of 147.63 g/mol. Its IUPAC name is 5-chloro-2,4-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name5-chloro-2,4-dimethyl-1,3-thiazole
PubChem CID20719823
Molecular FormulaC5H6ClNS
Molecular Weight147.63 g/mol
Exact Mass146.99
IUPAC Name5-chloro-2,4-dimethyl-1,3-thiazole
SMILESCc1nc(C)c(Cl)s1
InChIInChI=1S/C5H6ClNS/c1-3-5(6)8-4(2)7-3/h1-2H3
InChIKeyKSVOOXKOWOCYLP-UHFFFAOYSA-N
XLogP2.41
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.63
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-chloro-2,4-dimethyl-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2,4-dimethyl-1,3-thiazole?
The IUPAC name of 5-chloro-2,4-dimethyl-1,3-thiazole (CID 20719823) is 5-chloro-2,4-dimethyl-1,3-thiazole.
What is the SMILES notation for 5-chloro-2,4-dimethyl-1,3-thiazole?
The canonical SMILES for 5-chloro-2,4-dimethyl-1,3-thiazole is Cc1nc(C)c(Cl)s1.
What is the InChIKey of 5-chloro-2,4-dimethyl-1,3-thiazole?
The InChIKey is KSVOOXKOWOCYLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6ClNS/c1-3-5(6)8-4(2)7-3/h1-2H3.
What are the key properties of 5-chloro-2,4-dimethyl-1,3-thiazole?
5-chloro-2,4-dimethyl-1,3-thiazole has a molecular weight of 147.63 g/mol, XLogP of 2.41, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2,4-dimethyl-1,3-thiazole is sourced from PubChem (CID 20719823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).