2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole

C11H10ClNS — CID 6474282

IUPAC2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole
SMILESClc1ccc(/C=C\C2=NCCS2)cc1
InChIInChI=1S/C11H10ClNS/c12-10-4-1-9(2-5-10)3-6-11-13-7-8-14-11/h1-6H,7-8H2/b6-3-
InChIKeyMKKOSAUMIROTKP-UTCJRWHESA-N
MW223.73 g/mol
LogP3.50
Rot. Bonds2

About 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole

2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole (PubChem CID 6474282) has the molecular formula C11H10ClNS and a molecular weight of 223.73 g/mol. Its IUPAC name is 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole.

Molecular Properties

Compound Name2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole
PubChem CID6474282
Molecular FormulaC11H10ClNS
Molecular Weight223.73 g/mol
Exact Mass223.02
IUPAC Name2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole
SMILESClc1ccc(/C=C\C2=NCCS2)cc1
InChIInChI=1S/C11H10ClNS/c12-10-4-1-9(2-5-10)3-6-11-13-7-8-14-11/h1-6H,7-8H2/b6-3-
InChIKeyMKKOSAUMIROTKP-UTCJRWHESA-N
XLogP3.50
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.73
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole?
The IUPAC name of 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole (CID 6474282) is 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole.
What is the SMILES notation for 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole?
The canonical SMILES for 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole is Clc1ccc(/C=C\C2=NCCS2)cc1.
What is the InChIKey of 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole?
The InChIKey is MKKOSAUMIROTKP-UTCJRWHESA-N. The full InChI is InChI=1S/C11H10ClNS/c12-10-4-1-9(2-5-10)3-6-11-13-7-8-14-11/h1-6H,7-8H2/b6-3-.
What are the key properties of 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole?
2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole has a molecular weight of 223.73 g/mol, XLogP of 3.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-(4-chlorophenyl)ethenyl]-4,5-dihydro-1,3-thiazole is sourced from PubChem (CID 6474282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).