4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine

C16H12N4S — CID 25167075

IUPAC4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine
SMILESc1ccc(Nc2nc(-c3ccc4[nH]ncc4c3)cs2)cc1
InChIInChI=1S/C16H12N4S/c1-2-4-13(5-3-1)18-16-19-15(10-21-16)11-6-7-14-12(8-11)9-17-20-14/h1-10H,(H,17,20)(H,18,19)
InChIKeyCTJAMSGCMYAVCZ-UHFFFAOYSA-N
MW292.37 g/mol
LogP4.43
Rot. Bonds3

About 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine

4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine (PubChem CID 25167075) has the molecular formula C16H12N4S and a molecular weight of 292.37 g/mol. Its IUPAC name is 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine
PubChem CID25167075
Molecular FormulaC16H12N4S
Molecular Weight292.37 g/mol
Exact Mass292.08
IUPAC Name4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine
SMILESc1ccc(Nc2nc(-c3ccc4[nH]ncc4c3)cs2)cc1
InChIInChI=1S/C16H12N4S/c1-2-4-13(5-3-1)18-16-19-15(10-21-16)11-6-7-14-12(8-11)9-17-20-14/h1-10H,(H,17,20)(H,18,19)
InChIKeyCTJAMSGCMYAVCZ-UHFFFAOYSA-N
XLogP4.43
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.37
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(1H-indazol-5-yl)-N-phenyl-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-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine?
The IUPAC name of 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine (CID 25167075) is 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine is c1ccc(Nc2nc(-c3ccc4[nH]ncc4c3)cs2)cc1.
What is the InChIKey of 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine?
The InChIKey is CTJAMSGCMYAVCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4S/c1-2-4-13(5-3-1)18-16-19-15(10-21-16)11-6-7-14-12(8-11)9-17-20-14/h1-10H,(H,17,20)(H,18,19).
What are the key properties of 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine?
4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine has a molecular weight of 292.37 g/mol, XLogP of 4.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 25167075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).