5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine

C16H14N2O2S2 — CID 10758828

IUPAC5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine
SMILESCc1ccc(S(=O)(=O)c2sc(N)nc2-c2ccccc2)cc1
InChIInChI=1S/C16H14N2O2S2/c1-11-7-9-13(10-8-11)22(19,20)15-14(18-16(17)21-15)12-5-3-2-4-6-12/h2-10H,1H3,(H2,17,18)
InChIKeyOWMGEJPYQQSXEN-UHFFFAOYSA-N
MW330.43 g/mol
LogP3.53
Rot. Bonds3

About 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine

5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine (PubChem CID 10758828) has the molecular formula C16H14N2O2S2 and a molecular weight of 330.43 g/mol. Its IUPAC name is 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine
PubChem CID10758828
Molecular FormulaC16H14N2O2S2
Molecular Weight330.43 g/mol
Exact Mass330.05
IUPAC Name5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine
SMILESCc1ccc(S(=O)(=O)c2sc(N)nc2-c2ccccc2)cc1
InChIInChI=1S/C16H14N2O2S2/c1-11-7-9-13(10-8-11)22(19,20)15-14(18-16(17)21-15)12-5-3-2-4-6-12/h2-10H,1H3,(H2,17,18)
InChIKeyOWMGEJPYQQSXEN-UHFFFAOYSA-N
XLogP3.53
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine 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 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine (CID 10758828) is 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine is Cc1ccc(S(=O)(=O)c2sc(N)nc2-c2ccccc2)cc1.
What is the InChIKey of 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine?
The InChIKey is OWMGEJPYQQSXEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2S2/c1-11-7-9-13(10-8-11)22(19,20)15-14(18-16(17)21-15)12-5-3-2-4-6-12/h2-10H,1H3,(H2,17,18).
What are the key properties of 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine?
5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine has a molecular weight of 330.43 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)sulfonyl-4-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 10758828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).