[4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone

C15H11NOS2 — CID 63993298

IUPAC[4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone
SMILESCc1ccsc1-c1csc(C(=O)c2ccccc2)n1
InChIInChI=1S/C15H11NOS2/c1-10-7-8-18-14(10)12-9-19-15(16-12)13(17)11-5-3-2-4-6-11/h2-9H,1H3
InChIKeyWTGKTBGEJVBAGG-UHFFFAOYSA-N
MW285.39 g/mol
LogP4.41
Rot. Bonds3

About [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone

[4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone (PubChem CID 63993298) has the molecular formula C15H11NOS2 and a molecular weight of 285.39 g/mol. Its IUPAC name is [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone.

Molecular Properties

Compound Name[4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone
PubChem CID63993298
Molecular FormulaC15H11NOS2
Molecular Weight285.39 g/mol
Exact Mass285.03
IUPAC Name[4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone
SMILESCc1ccsc1-c1csc(C(=O)c2ccccc2)n1
InChIInChI=1S/C15H11NOS2/c1-10-7-8-18-14(10)12-9-19-15(16-12)13(17)11-5-3-2-4-6-11/h2-9H,1H3
InChIKeyWTGKTBGEJVBAGG-UHFFFAOYSA-N
XLogP4.41
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone 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-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone?
The IUPAC name of [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone (CID 63993298) is [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone.
What is the SMILES notation for [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone?
The canonical SMILES for [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone is Cc1ccsc1-c1csc(C(=O)c2ccccc2)n1.
What is the InChIKey of [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone?
The InChIKey is WTGKTBGEJVBAGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NOS2/c1-10-7-8-18-14(10)12-9-19-15(16-12)13(17)11-5-3-2-4-6-11/h2-9H,1H3.
What are the key properties of [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone?
[4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone has a molecular weight of 285.39 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]-phenylmethanone is sourced from PubChem (CID 63993298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).