(5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole

C22H17NS — CID 5358824

IUPAC(5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole
SMILESC(=C1\SC(c2ccccc2)=NC1c1ccccc1)\c1ccccc1
InChIInChI=1S/C22H17NS/c1-4-10-17(11-5-1)16-20-21(18-12-6-2-7-13-18)23-22(24-20)19-14-8-3-9-15-19/h1-16,21H/b20-16-
InChIKeyOGVIFLIVZKLLAY-SILNSSARSA-N
MW327.45 g/mol
LogP5.96
Rot. Bonds3

About (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole

(5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole (PubChem CID 5358824) has the molecular formula C22H17NS and a molecular weight of 327.45 g/mol. Its IUPAC name is (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole.

Molecular Properties

Compound Name(5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole
PubChem CID5358824
Molecular FormulaC22H17NS
Molecular Weight327.45 g/mol
Exact Mass327.11
IUPAC Name(5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole
SMILESC(=C1\SC(c2ccccc2)=NC1c1ccccc1)\c1ccccc1
InChIInChI=1S/C22H17NS/c1-4-10-17(11-5-1)16-20-21(18-12-6-2-7-13-18)23-22(24-20)19-14-8-3-9-15-19/h1-16,21H/b20-16-
InChIKeyOGVIFLIVZKLLAY-SILNSSARSA-N
XLogP5.96
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.45
LogP ≤ 55.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (5Z)-5-benzylidene-2,4-diphenyl-4H-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 (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole?
The IUPAC name of (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole (CID 5358824) is (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole.
What is the SMILES notation for (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole?
The canonical SMILES for (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole is C(=C1\SC(c2ccccc2)=NC1c1ccccc1)\c1ccccc1.
What is the InChIKey of (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole?
The InChIKey is OGVIFLIVZKLLAY-SILNSSARSA-N. The full InChI is InChI=1S/C22H17NS/c1-4-10-17(11-5-1)16-20-21(18-12-6-2-7-13-18)23-22(24-20)19-14-8-3-9-15-19/h1-16,21H/b20-16-.
What are the key properties of (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole?
(5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole has a molecular weight of 327.45 g/mol, XLogP of 5.96, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-benzylidene-2,4-diphenyl-4H-1,3-thiazole is sourced from PubChem (CID 5358824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).