2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole

C15H13N3S — CID 19417741

IUPAC2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole
SMILESc1ccc2c(c1)Cc1sc(CCn3ccnc3)nc1-2
InChIInChI=1S/C15H13N3S/c1-2-4-12-11(3-1)9-13-15(12)17-14(19-13)5-7-18-8-6-16-10-18/h1-4,6,8,10H,5,7,9H2
InChIKeyVSZMRUJBHNZPPP-UHFFFAOYSA-N
MW267.36 g/mol
LogP3.15
Rot. Bonds3

About 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole

2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole (PubChem CID 19417741) has the molecular formula C15H13N3S and a molecular weight of 267.36 g/mol. Its IUPAC name is 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole.

Molecular Properties

Compound Name2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole
PubChem CID19417741
Molecular FormulaC15H13N3S
Molecular Weight267.36 g/mol
Exact Mass267.08
IUPAC Name2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole
SMILESc1ccc2c(c1)Cc1sc(CCn3ccnc3)nc1-2
InChIInChI=1S/C15H13N3S/c1-2-4-12-11(3-1)9-13-15(12)17-14(19-13)5-7-18-8-6-16-10-18/h1-4,6,8,10H,5,7,9H2
InChIKeyVSZMRUJBHNZPPP-UHFFFAOYSA-N
XLogP3.15
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.36
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][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 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole?
The IUPAC name of 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole (CID 19417741) is 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole.
What is the SMILES notation for 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole?
The canonical SMILES for 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole is c1ccc2c(c1)Cc1sc(CCn3ccnc3)nc1-2.
What is the InChIKey of 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole?
The InChIKey is VSZMRUJBHNZPPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3S/c1-2-4-12-11(3-1)9-13-15(12)17-14(19-13)5-7-18-8-6-16-10-18/h1-4,6,8,10H,5,7,9H2.
What are the key properties of 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole?
2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole has a molecular weight of 267.36 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-imidazol-1-ylethyl)-4H-indeno[1,2-d][1,3]thiazole is sourced from PubChem (CID 19417741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).