3,5-dibenzyl-1,3-thiazol-2-one

C17H15NOS — CID 15122870

IUPAC3,5-dibenzyl-1,3-thiazol-2-one
SMILESO=c1sc(Cc2ccccc2)cn1Cc1ccccc1
InChIInChI=1S/C17H15NOS/c19-17-18(12-15-9-5-2-6-10-15)13-16(20-17)11-14-7-3-1-4-8-14/h1-10,13H,11-12H2
InChIKeyLGKXTRPXRPNJCW-UHFFFAOYSA-N
MW281.38 g/mol
LogP3.55
Rot. Bonds4

About 3,5-dibenzyl-1,3-thiazol-2-one

3,5-dibenzyl-1,3-thiazol-2-one (PubChem CID 15122870) has the molecular formula C17H15NOS and a molecular weight of 281.38 g/mol. Its IUPAC name is 3,5-dibenzyl-1,3-thiazol-2-one.

Molecular Properties

Compound Name3,5-dibenzyl-1,3-thiazol-2-one
PubChem CID15122870
Molecular FormulaC17H15NOS
Molecular Weight281.38 g/mol
Exact Mass281.09
IUPAC Name3,5-dibenzyl-1,3-thiazol-2-one
SMILESO=c1sc(Cc2ccccc2)cn1Cc1ccccc1
InChIInChI=1S/C17H15NOS/c19-17-18(12-15-9-5-2-6-10-15)13-16(20-17)11-14-7-3-1-4-8-14/h1-10,13H,11-12H2
InChIKeyLGKXTRPXRPNJCW-UHFFFAOYSA-N
XLogP3.55
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.38
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,5-dibenzyl-1,3-thiazol-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 3,5-dibenzyl-1,3-thiazol-2-one?
The IUPAC name of 3,5-dibenzyl-1,3-thiazol-2-one (CID 15122870) is 3,5-dibenzyl-1,3-thiazol-2-one.
What is the SMILES notation for 3,5-dibenzyl-1,3-thiazol-2-one?
The canonical SMILES for 3,5-dibenzyl-1,3-thiazol-2-one is O=c1sc(Cc2ccccc2)cn1Cc1ccccc1.
What is the InChIKey of 3,5-dibenzyl-1,3-thiazol-2-one?
The InChIKey is LGKXTRPXRPNJCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NOS/c19-17-18(12-15-9-5-2-6-10-15)13-16(20-17)11-14-7-3-1-4-8-14/h1-10,13H,11-12H2.
What are the key properties of 3,5-dibenzyl-1,3-thiazol-2-one?
3,5-dibenzyl-1,3-thiazol-2-one has a molecular weight of 281.38 g/mol, XLogP of 3.55, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibenzyl-1,3-thiazol-2-one is sourced from PubChem (CID 15122870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).