[2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol

C17H13N3OS — CID 22259281

IUPAC[2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol
SMILESOCc1sc(-c2n[nH]c3ccccc23)nc1-c1ccccc1
InChIInChI=1S/C17H13N3OS/c21-10-14-15(11-6-2-1-3-7-11)18-17(22-14)16-12-8-4-5-9-13(12)19-20-16/h1-9,21H,10H2,(H,19,20)
InChIKeySRGHLFMGVBQHGN-UHFFFAOYSA-N
MW307.38 g/mol
LogP3.85
Rot. Bonds3

About [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol

[2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol (PubChem CID 22259281) has the molecular formula C17H13N3OS and a molecular weight of 307.38 g/mol. Its IUPAC name is [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol
PubChem CID22259281
Molecular FormulaC17H13N3OS
Molecular Weight307.38 g/mol
Exact Mass307.08
IUPAC Name[2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol
SMILESOCc1sc(-c2n[nH]c3ccccc23)nc1-c1ccccc1
InChIInChI=1S/C17H13N3OS/c21-10-14-15(11-6-2-1-3-7-11)18-17(22-14)16-12-8-4-5-9-13(12)19-20-16/h1-9,21H,10H2,(H,19,20)
InChIKeySRGHLFMGVBQHGN-UHFFFAOYSA-N
XLogP3.85
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol 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 [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol (CID 22259281) is [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol is OCc1sc(-c2n[nH]c3ccccc23)nc1-c1ccccc1.
What is the InChIKey of [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol?
The InChIKey is SRGHLFMGVBQHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3OS/c21-10-14-15(11-6-2-1-3-7-11)18-17(22-14)16-12-8-4-5-9-13(12)19-20-16/h1-9,21H,10H2,(H,19,20).
What are the key properties of [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol?
[2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol has a molecular weight of 307.38 g/mol, XLogP of 3.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1H-indazol-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 22259281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).