4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine

C7H4Cl2N2S2 — CID 959110

IUPAC4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2cc(Cl)sc2Cl)cs1
InChIInChI=1S/C7H4Cl2N2S2/c8-5-1-3(6(9)13-5)4-2-12-7(10)11-4/h1-2H,(H2,10,11)
InChIKeyZQLZXFNAKNVLPB-UHFFFAOYSA-N
MW251.16 g/mol
LogP3.76
Rot. Bonds1

About 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine

4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine (PubChem CID 959110) has the molecular formula C7H4Cl2N2S2 and a molecular weight of 251.16 g/mol. Its IUPAC name is 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine
PubChem CID959110
Molecular FormulaC7H4Cl2N2S2
Molecular Weight251.16 g/mol
Exact Mass249.92
IUPAC Name4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2cc(Cl)sc2Cl)cs1
InChIInChI=1S/C7H4Cl2N2S2/c8-5-1-3(6(9)13-5)4-2-12-7(10)11-4/h1-2H,(H2,10,11)
InChIKeyZQLZXFNAKNVLPB-UHFFFAOYSA-N
XLogP3.76
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine 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 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine (CID 959110) is 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine is Nc1nc(-c2cc(Cl)sc2Cl)cs1.
What is the InChIKey of 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine?
The InChIKey is ZQLZXFNAKNVLPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4Cl2N2S2/c8-5-1-3(6(9)13-5)4-2-12-7(10)11-4/h1-2H,(H2,10,11).
What are the key properties of 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine?
4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine has a molecular weight of 251.16 g/mol, XLogP of 3.76, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 959110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).