4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one

C26H25N7O2S — CID 118258052

IUPAC4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one
SMILESCc1nn2ccc(OCCN3CCNC(=O)C3)cc2c1-c1nc(-c2ccccc2)c(-c2ncc[nH]2)s1
InChIInChI=1S/C26H25N7O2S/c1-17-22(26-30-23(18-5-3-2-4-6-18)24(36-26)25-28-8-9-29-25)20-15-19(7-11-33(20)31-17)35-14-13-32-12-10-27-21(34)16-32/h2-9,11,15H,10,12-14,16H2,1H3,(H,27,34)(H,28,29)
InChIKeyOEJHTDZKWDFQQH-UHFFFAOYSA-N
MW499.60 g/mol
LogP3.63
Rot. Bonds7

About 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one

4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one (PubChem CID 118258052) has the molecular formula C26H25N7O2S and a molecular weight of 499.60 g/mol. Its IUPAC name is 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one.

Molecular Properties

Compound Name4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one
PubChem CID118258052
Molecular FormulaC26H25N7O2S
Molecular Weight499.60 g/mol
Exact Mass499.18
IUPAC Name4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one
SMILESCc1nn2ccc(OCCN3CCNC(=O)C3)cc2c1-c1nc(-c2ccccc2)c(-c2ncc[nH]2)s1
InChIInChI=1S/C26H25N7O2S/c1-17-22(26-30-23(18-5-3-2-4-6-18)24(36-26)25-28-8-9-29-25)20-15-19(7-11-33(20)31-17)35-14-13-32-12-10-27-21(34)16-32/h2-9,11,15H,10,12-14,16H2,1H3,(H,27,34)(H,28,29)
InChIKeyOEJHTDZKWDFQQH-UHFFFAOYSA-N
XLogP3.63
TPSA100.44 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500499.60
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one 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-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one?
The IUPAC name of 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one (CID 118258052) is 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one.
What is the SMILES notation for 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one?
The canonical SMILES for 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one is Cc1nn2ccc(OCCN3CCNC(=O)C3)cc2c1-c1nc(-c2ccccc2)c(-c2ncc[nH]2)s1.
What is the InChIKey of 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one?
The InChIKey is OEJHTDZKWDFQQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N7O2S/c1-17-22(26-30-23(18-5-3-2-4-6-18)24(36-26)25-28-8-9-29-25)20-15-19(7-11-33(20)31-17)35-14-13-32-12-10-27-21(34)16-32/h2-9,11,15H,10,12-14,16H2,1H3,(H,27,34)(H,28,29).
What are the key properties of 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one?
4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one has a molecular weight of 499.60 g/mol, XLogP of 3.63, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[3-[5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]piperazin-2-one is sourced from PubChem (CID 118258052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).